Summary

IMPPAT Phytochemical identifier: IMPHY009840

Phytochemical name: Cyclosativene

Synonymous chemical names:
(+ )-cyclosativene, (+)-cyclosativene, cyclo sativene, cyclosativene, cyclosativene(1,2,4-metheno-1h-indene,octahydro-1,7a-dimethyl-5-

External chemical identifiers:
CID:519960

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Chemical structure information

SMILES:
CC(C1CCC2(C3C1C1C(C21C)C3)C)C

InChI:
InChI=1S/C15H24/c1-8(2)9-5-6-14(3)10-7-11-13(12(9)10)15(11,14)4/h8-13H,5-7H2,1-4H3

InChIKey:
XBWACJDEQIZTPR-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCC6CCC63C))C5)))))C)))))C

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CC2C3CC4C2C4C3C1

Scaffold Graph/Node level:
C1CC2C3CC4C2C4C3C1

Scaffold Graph level:
C1CC2C3CC4C2C4C3C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Sesquiterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Sativane sesquiterpenoids

NP-Likeness score: 2.753

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Chemical structure download