Summary

IMPPAT Phytochemical identifier: IMPHY005895

Phytochemical name: p-Menthan-4-ol

Synonymous chemical names:
p-menthan-4-ol

External chemical identifiers:
CID:574674, ChEBI:166667, ZINC:ZINC000014588589, SureChEMBL:SCHEMBL8084874

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Chemical structure information

SMILES:
CC1CCC(CC1)(O)C(C)C

InChI:
InChI=1S/C10H20O/c1-8(2)10(11)6-4-9(3)5-7-10/h8-9,11H,4-7H2,1-3H3

InChIKey:
LWKGCZOYSGKTLB-UHFFFAOYSA-N

DeepSMILES:
CCCCCCC6))O)CC)C

Functional groups:
CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCCCC1

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: 1.373

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Chemical structure download