Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID014056

Phytochemical name: m-Menth-1-en-8-ol

Synonymous chemical names:
m-menth-1-en-8-ol

External chemical identifiers:
CID:CID_91748537

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Chemical structure information

SMILES:
CC1=CC(CCC1)C(O)(C)C

InChI:
InChI=1S/C10H18O/c1-8-5-4-6-9(7-8)10(2,3)11/h7,9,11H,4-6H2,1-3H3

InChIKey:
WXGGKAIQYISKCW-UHFFFAOYSA-N

DeepSMILES:
CC=CCCCC6)))CO)C)C

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

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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: 2.22

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Chemical structure download