Summary

IMPPAT Phytochemical identifier: IMPHY001661

Phytochemical name: Cyperol

Synonymous chemical names:
cyperol

External chemical identifiers:
CID:14076601, ChEMBL:CHEMBL2268862, ChEBI:80813

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Chemical structure information

SMILES:
CC(=C)[C@@H]1CC[C@@]2(C(=C(C)[C@@H](CC2)O)C1)C

InChI:
InChI=1S/C15H24O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12,14,16H,1,5-9H2,2-4H3/t12-,14-,15+/m1/s1

InChIKey:
APWLDLGOYJHNIK-YUELXQCFSA-N

DeepSMILES:
CC=C)[C@@H]CC[C@@]C=CC)[C@@H]CC6))O)))C6))C

Functional groups:
C=C(C)C, CC(C)=C(C)C, CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=C2CCCCC2CCC1

Scaffold Graph/Node level:
C1CCC2CCCCC2C1

Scaffold Graph level:
C1CCC2CCCCC2C1

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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: Eudesmane sesquiterpenoids

NP-Likeness score: 2.99

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Chemical structure download