Summary
IMPPAT Phytochemical identifier: IMPHY014701
Phytochemical name: d-Carvone
Synonymous chemical names:(+)-(s)-carvone, (+)-carvone, (s)(+)carvone, carvone+
External chemical identifiers:CID:16724, ChEMBL:CHEMBL501949, ChEBI:15399, ZINC:ZINC000000968102, FDASRS:4RWC1CMS3X, SureChEMBL:SCHEMBL184022, MolPort-001-769-671
Chemical structure information
SMILES:
CC(=C)[C@H]1CC=C(C(=O)C1)CInChI:
InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3/t9-/m0/s1InChIKey:
ULDHMXUKGWMISQ-VIFPVBQESA-NDeepSMILES:
CC=C)[C@H]CC=CC=O)C6))CFunctional groups:
C=C(C)C, CC=C(C)C(C)=O
Molecular scaffolds
Scaffold Graph/Node/Bond level:
O=C1C=CCCC1Scaffold Graph/Node level:
OC1CCCCC1Scaffold Graph level:
CC1CCCCC1
Chemical classification
ClassyFire Kingdom: Organic compoundsClassyFire Superclass: Lipids and lipid-like moleculesClassyFire 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
Chemical structure download