Summary

IMPPAT Phytochemical identifier: IMPHY015879

Phytochemical name: p-Mentha-3-en-8-ol

Synonymous chemical names:
p-menth-3-en-8-ol, para-menth-3-en-8-ol

External chemical identifiers:
CID:6430773

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Chemical structure information

SMILES:
OCC(C1=CCC(CC1)C)(C)C

InChI:
InChI=1S/C11H20O/c1-9-4-6-10(7-5-9)11(2,3)8-12/h6,9,12H,4-5,7-8H2,1-3H3

InChIKey:
GRWJGTVTFCENHD-UHFFFAOYSA-N

DeepSMILES:
OCCC=CCCCC6))C)))))C)C

Functional groups:
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: Monoterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Monoterpenoids

NP Classifier Class: Menthane monoterpenoids, Monocyclic monoterpenoids

NP-Likeness score: 1.411

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Chemical structure download