Summary

IMPPAT Phytochemical identifier: IMPHY006660

Phytochemical name: cis-Lanceol

Synonymous chemical names:
cis-lanceol, cis-lanceol ?

External chemical identifiers:
CID:6536796

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Chemical structure information

SMILES:
OC/C(=C/CCC(=C)C1CCC(=CC1)C)/C

InChI:
InChI=1S/C15H24O/c1-12-7-9-15(10-8-12)14(3)6-4-5-13(2)11-16/h5,7,15-16H,3-4,6,8-11H2,1-2H3/b13-5+

InChIKey:
HBVOEGGRCJCMLG-WLRTZDKTSA-N

DeepSMILES:
OC/C=C/CCC=C)CCCC=CC6))C)))))))))/C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCCCC1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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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: Bisabolane sesquiterpenoids

NP-Likeness score: 3.195

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Chemical structure download