ChEBI
  Marvin  06180814472D          

 11 11  0  0  1  0            999 V2000
   12.4002   -2.2026    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.7006   -1.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9884   -2.2026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9884   -3.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7006   -3.4519    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   12.4002   -3.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1248   -1.8028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7006   -0.9409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9760   -4.6887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7006   -4.2764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4002   -4.6887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  3  2  2  0  0  0  0
  8  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  5 10  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
M  END
> <ID>
CHEBI:23046

> <NAME>
carveol

> <DEFINITION>
A limonene monoterpenoid that is cyclohex-2-en-1-ol substituted by a methyl group at position 2 and a prop-1-en-2-yl group at position 5.

> <STAR>
3

> <SYNONYM>
p-Mentha-6,8-dien-2-ol; p-Mentha-1,8-dien-6-ol; 5-Isopropenyl-2-methyl-2-cyclohexen-1-ol

> <IUPAC_NAME>
2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol

> <FORMULA>
C10H16O

> <MASS>
152.23344

> <MONOISOTOPIC_MASS>
152.12012

> <CHARGE>
0

> <SMILES>
CC(=C)C1CC=C(C)C(O)C1

> <INCHI>
InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3

> <INCHIKEY>
BAVONGHXFVOKBV-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1861032

> <CAS_REGISTRY_NUMBER>
99-48-9

> <REAXYS_REGISTRY_NUMBER>
1861032

> <CHEMIDPLUS>
99-48-9

> <PUBMED_CITATION>
23545130; 24488719

$$$$