Summary

IMPPAT Phytochemical identifier: IMPHY009988

Phytochemical name: 2-Methyl-6-methyleneoct-7-en-4-ol

Synonymous chemical names:
ipsenol

External chemical identifiers:
CID:85712, SureChEMBL:SCHEMBL379143, MolPort-004-968-414

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Chemical structure information

SMILES:
C=CC(=C)CC(CC(C)C)O

InChI:
InChI=1S/C10H18O/c1-5-9(4)7-10(11)6-8(2)3/h5,8,10-11H,1,4,6-7H2,2-3H3

InChIKey:
RHAXCOKCIAVHPB-UHFFFAOYSA-N

DeepSMILES:
C=CC=C)CCCCC)C)))O

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

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP-Likeness score: 1.901

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Chemical structure download