LOTUS: Natural Products Online

Q27132747

Name	Bicyclogermacrene
Wikidata	Q27132747
Mol. formula	C15H24
CAS registry number	-
Mol. weight	204.3516

Representations

Temporary LOTUS id	LTS0099340
Name	Bicyclogermacrene
Canonical SMILES	C/C1=C\[C@H]2[C@@H](CC/C(C)=C/CC1)C2(C)C
2D SMILES	CC1=CC2C(CCC(C)=CCC1)C2(C)C
IUPAC name	(1S,2E,6E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
InChI	InChI=1S/C15H24/c1-11-6-5-7-12(2)10-14-13(9-8-11)15(14,3)4/h6,10,13-14H,5,7-9H2,1-4H3/b11-6+,12-10+/t13-,14+/m1/s1
InChIKey	VPDZRSSKICPUEY-JEPMYXAXSA-N
Deep SMILES	could not be computed
Murcko Framework	C1=CCCC2CC2C=CCC1

Organism taxonomy

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Cassinia	Cassinia uncata

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Cassinia	Cassinia uncata

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Cassinia	Cassinia uncata

Ref:

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Ichthyothere	Ichthyothere terminalis

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Ichthyothere	Ichthyothere terminalis

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Ichthyothere	Ichthyothere terminalis

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Podocarpaceae	Prumnopitys	Prumnopitys andina

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Podocarpaceae	Prumnopitys	Prumnopitys andina

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Podocarpaceae	Prumnopitys	Prumnopitys andina
Plantae	Tracheophyta	Podocarpaceae	Podocarpus	Podocarpus spicatus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Mattfeldanthus	Mattfeldanthus andrade-limae

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Mattfeldanthus	Mattfeldanthus andrade-limae

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Geigeria	Geigeria aspera
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Geigeria	Geigeria burkei
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Geigeria	Geigeria brevifolia

Superkingdom	Kingdom	Phylum	Family	Genus	Species
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Geigeria	Geigeria brevifolia
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Geigeria	Geigeria burkei
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Geigeria	Geigeria aspera

Kingdom	Phylum	Family	Genus	Species
Plantae	Tracheophyta	Asteraceae	Geigeria	Geigeria brevifolia
Plantae	Tracheophyta	Asteraceae	Geigeria	Geigeria aspera
Plantae	Tracheophyta	Asteraceae	Geigeria	Geigeria burkei
Plantae	Tracheophyta	Asteraceae	Geigeria	Geigeria burkei
Plantae	Tracheophyta	Asteraceae	Geigeria	Geigeria burkei

Ref:

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Artemisia	Artemisia annua

Kingdom	Family	Genus	Species
Plantae	Asteraceae	Artemisia	Artemisia annua

Family	Genus	Species
Asteraceae	Artemisia	Artemisia annua

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Artemisia	Artemisia annua

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Artemisia	Artemisia annua

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Artemisia	Artemisia annua

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Ophryosporus	Ophryosporus floribundus

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Ophryosporus	Ophryosporus floribundus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Callilepis	Callilepis laureola

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Callilepis	Callilepis laureola

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Callilepis	Callilepis laureola

Ref:

Kingdom	Family	Genus	Species
Plantae	Frullaniaceae	Frullania	Frullania fragilifolia
Plantae	Valerianaceae	Valeriana	Valeriana officinalis

Family	Genus	Species
Caprifoliaceae	Valeriana	Valeriana officinalis

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Frullaniaceae	Frullania	Frullania fragilifolia
Eukaryota	Archaeplastida	Streptophyta	Caprifoliaceae	Valeriana	Valeriana officinalis

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Caprifoliaceae	Valeriana	Valeriana officinalis
Eukaryota	Viridiplantae	Streptophyta	Frullaniaceae	Frullania	Frullania fragilifolia

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Caprifoliaceae	Valeriana	Valeriana officinalis
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania fragilifolia

Ref:

Kingdom	Family	Genus	Species
Plantae	Lophoziaceae	Trilophozia	Trilophozia quinquedentata

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Scapaniaceae	Tritomaria	Tritomaria quinquedentata

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Lophoziaceae	Tritomaria	Tritomaria quinquedentata

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Marchantiophyta	Lophoziaceae	Trilophozia	Trilophozia quinquedentata

Ref:

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Inezia	Inezia integrifolia

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Inezia	Inezia integrifolia

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Inezia	Inezia integrifolia

Ref:

Kingdom	Family	Genus	Species
Plantae	Asteraceae	Bidens	Bidens cynapiifolia

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Bidens	Bidens cynapiifolia

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Bidens	Bidens cynapiifolia

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Bidens	Bidens cynapiifolia

Ref:

Kingdom	Family	Genus	Species
Plantae	Frullaniaceae	Frullania	Frullania solanderiana
Plantae	Frullaniaceae	Frullania	Frullania spinifera
Plantae	Frullaniaceae	Frullania	Frullania incumbens
Plantae	Frullaniaceae	Frullania	Frullania monocera
Plantae	Frullaniaceae	Frullania	Frullania media

Superkingdom	Kingdom	Phylum	Family	Genus	Species
Eukaryota	Viridiplantae	Streptophyta	Frullaniaceae	Frullania	Frullania spinifera
Eukaryota	Viridiplantae	Streptophyta	Frullaniaceae	Frullania	Frullania incumbens
Eukaryota	Viridiplantae	Streptophyta	Frullaniaceae	Frullania	Frullania monocera
Eukaryota	Viridiplantae	Streptophyta	Frullaniaceae	Frullania	Frullania solanderiana

Domain	Kingdom	Phylum	Family	Genus	Species
Eukaryota	Archaeplastida	Streptophyta	Frullaniaceae	Frullania	Frullania spinifera
Eukaryota	Archaeplastida	Streptophyta	Frullaniaceae	Frullania	Frullania monocera
Eukaryota	Archaeplastida	Streptophyta	Frullaniaceae	Frullania	Frullania media
Eukaryota	Archaeplastida	Streptophyta	Frullaniaceae	Frullania	Frullania incumbens
Eukaryota	Archaeplastida	Streptophyta	Frullaniaceae	Frullania	Frullania solanderiana

Kingdom	Phylum	Family	Genus	Species
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania aterrima
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania monocera
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania media
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania aterrima
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania spinifera
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania incumbens
Plantae	Marchantiophyta	Frullaniaceae	Frullania	Frullania solanderiana

Ref:

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Solidago	Solidago spathulata

Kingdom	Family	Genus	Species
Plantae	Asteraceae	Solidago	Solidago spathulata

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Solidago	Solidago spathulata

Ref:

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Stilpnopappus	Stilpnopappus tomentosus
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Stilpnopappus	Stilpnopappus glomeratus

Domain	Kingdom	Phylum	Family	Genus	Species
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Stilpnopappus	Stilpnopappus trichospiroides
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Stilpnopappus	Stilpnopappus glomeratus
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Stilpnopappus	Stilpnopappus tomentosus

Kingdom	Phylum	Family	Genus	Species
Plantae	Tracheophyta	Asteraceae	Stilpnopappus	Stilpnopappus glomeratus
Plantae	Tracheophyta	Asteraceae	Stilpnopappus	Stilpnopappus trichospiroides
Plantae	Tracheophyta	Asteraceae	Stilpnopappus	Stilpnopappus tomentosus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Ptilidiaceae	Ptilidium	Ptilidium ciliare

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Mikania	Mikania pohlii

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Nidorella	Nidorella podocephala

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Senecio	Senecio oxyodontus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Helichrysum	Helichrysum herbaceum

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Stevia	Stevia polyphylla
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Stevia	Stevia samaipatensis

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Artemisia	Artemisia schmidtiana

Ref:

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Apiaceae	Ferula	Ferula ferulioides

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Solidago	Solidago canadensis

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Anthemis	Anthemis aciphylla

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Vernonia	Vernonia natalensis
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Hilliardiella	Hilliardiella aristata

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Vernonia	Vernonia natalensis
Eukaryota	Viridiplantae	Streptophyta	Asteraceae	Hilliardiella	Hilliardiella aristata

Kingdom	Phylum	Family	Genus	Species
Plantae	Tracheophyta	Asteraceae	Pseudopegolettia	Pseudopegolettia tenella
Plantae	Tracheophyta	Asteraceae	Vernonia	Vernonia natalensis
Plantae	Tracheophyta	Asteraceae	Hilliardiella	Hilliardiella aristata

Ref:

Superkingdom	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Eukaryota	Viridiplantae	Streptophyta	Piperaceae	Piper	Piper arboreum
Eukaryota	Viridiplantae	Streptophyta	Piperaceae	Piper	Piper fimbriulatum

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Piperaceae	Piper	Piper arboreum
Eukaryota	Archaeplastida	Streptophyta	Piperaceae	Piper	Piper fimbriulatum

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Baccharis	Baccharis tricuneata

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Clibadium	Clibadium armanii

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Verbesina	Verbesina sordescens

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Planaltoa	Planaltoa lychnophoroides

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Heterotheca	Heterotheca subaxillaris

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Verbesina	Verbesina luetzelburgii

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Goyazianthus	Goyazianthus tetrastichus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Eremanthus	Eremanthus crotonoides

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Brickellia	Brickellia veronicaefolia

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Stevia	Stevia amambayensis

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Podocarpaceae	Halocarpus	Halocarpus bidwillii

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Senecio	Senecio coronatus
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Senecio	Senecio pleistocephalus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Lessingianthus	Lessingianthus compactiflorus

Kingdom	Phylum	Family	Genus	Species	Link to taxonomy
Plantae	Tracheophyta	Asteraceae	Vernonia	Vernonia compactiflora
Plantae	Tracheophyta	Asteraceae	Lessingianthus	Lessingianthus compactiflorus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Burseraceae	Commiphora	Commiphora kataf

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Ursinia	Ursinia nana

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Senecio	Senecio subrubriflorus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Dimerostemma	Dimerostemma brasilianum

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Acoraceae	Acorus	Acorus calamus

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Calea	Calea hispida

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Wedelia	Wedelia hookeriana

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Rutaceae	Citrus	Citrus sinensis

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Perymeniopsis	Perymeniopsis ovalifolia

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Curio	Curio talinoides

Ref:

Domain	Kingdom	Phylum	Family	Genus	Species	Link to taxonomy	Link to Wikidata
Eukaryota	Archaeplastida	Streptophyta	Asteraceae	Nidorella	Nidorella podocephala

Ref:

Chemical ontology

Pathway	Superclass	Class
Terpenoids	Sesquiterpenoids	Bicyclogermacrane sesquiterpenoids

Molecular Properties

Total atom number	39
Heavy atom number	15
Bond count	16
Number of carbons	15
Minimal number of rings	2
Maximal number of rings	3

Molecular Descriptors

NP-likeness score	1
Alogp	4.7
Alogp2	22.08
Apol	42.403
Bpol	26.237
EccentricConnectivityIndexDescriptor	172
FmfDescriptor	0.7333
Fsp3	0.7333
FragmentComplexityDescriptor	1390
PetitjeanNumber	0.1667
LipinskiRuleOf5Failures	1
WienerPathNumber	346
Xlogp	5.999
ZagrebIndex	80
TopoPSA	0

Kingdom	Superclass	Class	Direct Parent
Organic compounds	Lipids and lipid-like molecules	Prenol lipids	Bicyclogermacrane and isolepidozane sesquiterpenoids