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Substance Name: Coccinine, (+/-)-
RN: 139068-98-7
UNII: 3SRR5RK902
InChIKey: MKYLOMHWHWEFCT-ZQDZILKHSA-N

Molecular Formula

  • C17-H19-N-O4

Molecular Weight

  • 301.3401
 
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Names and Synonyms

Name of Substance

  • Coccinine, (+/-)-

Synonyms

  • (+/-)-Coccinine
  • 6,11-Methano-6H-1,3-benzodioxolo(5,6-C)(1)benzazepin-8-ol, 5,6a,7,8,9,11-hexahydro-9-methoxy-, (6alpha,6abeta,8beta,9beta,11alpha)-
  • 6,11-Methano-6H-benzo(b)-1,3-benzodioxolo(5,6-E)azepin-8-ol, 5,6a,7,8,9,11-hexahydro-9-methoxy-, (6R,6aS,8S,9R,11S)-rel-
  • Coccinine, (+/-)-
  • Pancracine, O2-methyl-, (2beta)-(+/-)-
  • UNII-3SRR5RK902

Registry Numbers

CAS Registry Number

  • 139068-98-7

FDA UNII

  • 3SRR5RK902

System Generated Number

  • 0139068987

Structure Descriptors

InChI

1S/C17H19NO4/c1-20-15-4-11-12-7-18(13(11)5-14(15)19)6-9-2-16-17(3-10(9)12)22-8-21-16/h2-4,12-15,19H,5-8H2,1H3/t12-,13-,14-,15+/m0/s1

InChIKey

MKYLOMHWHWEFCT-ZQDZILKHSA-N

Smiles

CO[C@@H]1C=C2[C@H](C[C@@H]1O)N3C[C@H]2c4cc5OCOc5cc4C3