Ketcher 01152013542D 1   1.00000     0.00000     0

 12 12  0     1  0            999 V2000
   10.4608   -5.7586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4608   -6.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5959   -5.2593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5959   -7.2564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7312   -5.7586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7312   -6.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6055   -4.2797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5565   -3.7187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6055   -8.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7400   -8.7686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3474   -8.7972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7584   -7.8003    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  3  1  2  0     0  0
  4  2  1  0     0  0
  5  3  1  0     0  0
  6  4  1  0     0  0
  6  5  1  0     0  0
  7  3  1  0     0  0
  8  7  1  0     0  0
  4  9  1  0     0  0
 10  9  2  0     0  0
 11  9  1  0     0  0
  4 12  1  1     0  0
M  END
> <ID>
CHEBI:145806

> <NAME>
(R)-(+)-perillyl alcohol

> <DEFINITION>
A perillyl alcohol in which the chiral centre has R configuration.

> <STAR>
3

> <SYNONYM>
d-perillyl alcohol; (R)-perillyl alcohol; (R)-p-mentha-1,8-dien-7-ol; (4R)-perillyl alcohol; (4R)-perillyl alcohol; (+)-perillyl alcohol

> <IUPAC_NAME>
[(4R)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol

> <FORMULA>
C10H16O

> <MASS>
152.237

> <MONOISOTOPIC_MASS>
152.12012

> <CHARGE>
0

> <SMILES>
C=1C[C@@](CCC1CO)(C(=C)C)[H]

> <INCHI>
InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3/t10-/m0/s1

> <INCHIKEY>
NDTYTMIUWGWIMO-JTQLQIEISA-N

> <CAS_REGISTRY_NUMBER>
57717-97-2

> <KNAPSACK_ACCESSION>
C00010884

> <METACYC_ACCESSION>
CPD-17084

> <PUBMED_CITATION>
28233648; 28594456; 29716998

$$$$