Summary

IMPPAT Phytochemical identifier: IMPHY017546

Phytochemical name: Dihydro-cis-alpha-copaene-8-ol

Synonymous chemical names:
dihydro-cis-α-copaene-8-ol

External chemical identifiers:
CID:595121

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Chemical structure information

SMILES:
CC(C1C(O)CC2(C3C1C2C(CC3)C)C)C

InChI:
InChI=1S/C15H26O/c1-8(2)12-11(16)7-15(4)10-6-5-9(3)14(15)13(10)12/h8-14,16H,5-7H2,1-4H3

InChIKey:
QULDBKHTWZIUJN-UHFFFAOYSA-N

DeepSMILES:
CCCCO)CCCC6C4CCC6))C)))))C)))))C

Functional groups:
CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CC2C3CCCC2C3C1

Scaffold Graph/Node level:
C1CC2C3CCCC2C3C1

Scaffold Graph level:
C1CC2C3CCCC2C3C1

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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: Copaane sesquiterpenoids

NP-Likeness score: 2.943

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Chemical structure download