Summary

IMPPAT Phytochemical identifier: IMPHY012002

Phytochemical name: (+)-Dihydrocarvone

Synonymous chemical names:
(+)-dihydrocarvone, (e )-dihydrocarvone*****, (e)-dihydrocarvone, d-dihydrocarvone, dihydrocarvone

External chemical identifiers:
CID:22227, ChEMBL:CHEMBL2268553, ChEBI:154, ZINC:ZINC000000967816, FDASRS:VTA43H364Z, SureChEMBL:SCHEMBL437688, MolPort-006-116-972

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Chemical structure information

SMILES:
CC(=C)[C@@H]1CC[C@H](C(=O)C1)C

InChI:
InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h8-9H,1,4-6H2,2-3H3/t8-,9-/m1/s1

InChIKey:
AZOCECCLWFDTAP-RKDXNWHRSA-N

DeepSMILES:
CC=C)[C@@H]CC[C@H]C=O)C6))C

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

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCCCC1

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: 2.118

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Chemical structure download