Summary

IMPPAT Phytochemical identifier: IMPHY012075

Phytochemical name: Carvone

Synonymous chemical names:
1-carvone, carvone, catvone

External chemical identifiers:
CID:7439, ChEMBL:CHEMBL15676, ChEBI:38265, FDASRS:75GK9XIA8I, SureChEMBL:SCHEMBL39408, MolPort-002-506-968

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Chemical structure information

SMILES:
CC(=C)C1CC=C(C(=O)C1)C

InChI:
InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3

InChIKey:
ULDHMXUKGWMISQ-UHFFFAOYSA-N

DeepSMILES:
CC=C)CCC=CC=O)C6))C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=CCCC1

Scaffold Graph/Node level:
OC1CCCCC1

Scaffold Graph level:
CC1CCCCC1

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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

NP-Likeness score: 2.301

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Chemical structure download