Marvin  02020822342D          

 20 23  0  0  0  0            999 V2000
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7144    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7144   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7144    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4435    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    1.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    2.0626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290   -0.8250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2259   -0.6115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 11 10  1  0  0  0  0
 13  1  1  0  0  0  0
  2 14  1  0  0  0  0
  1  5  2  0  0  0  0
  2  1  1  0  0  0  0
  4  2  2  0  0  0  0
  3 17  2  0  0  0  0
  3  5  1  0  0  0  0
 17  4  1  0  0  0  0
  9 11  1  0  0  0  0
 14 11  1  0  0  0  0
 14  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10 19  1  6  0  0  0
 19 16  1  0  0  0  0
 11 12  1  6  0  0  0
 14 15  1  6  0  0  0
 15 16  1  0  0  0  0
 13 10  1  0  0  0  0
 17 18  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
> <ID>
CHEBI:29133

> <NAME>
dextrorphan

> <STAR>
3

> <SYNONYM>
d-3-hydroxy-N-methylmorphinan; (+)-3-hydroxy-N-methylmorphinan

> <IUPAC_NAME>
17-methyl-9alpha,13alpha,14alpha-morphinan-3-ol

> <INN>
dextrorphanum; dextrorphane; dextrorphan

> <FORMULA>
C17H23NO

> <MASS>
257.37066

> <MONOISOTOPIC_MASS>
257.17796

> <CHARGE>
0

> <SMILES>
[H][C@]12CCCC[C@]11CCN(C)[C@H]2Cc2ccc(O)cc12

> <INCHI>
InChI=1S/C17H23NO/c1-18-9-8-17-7-3-2-4-14(17)16(18)10-12-5-6-13(19)11-15(12)17/h5-6,11,14,16,19H,2-4,7-10H2,1H3/t14-,16+,17+/m1/s1

> <INCHIKEY>
JAQUASYNZVUNQP-PVAVHDDUSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
88093

> <CAS_REGISTRY_NUMBER>
125-73-5

> <CHEMIDPLUS>
125-73-5

> <LINCS_ACCESSION>
LSM-36603

$$$$