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Substance Name: CDB 4453
RN: 365416-28-0
UNII: 48I9KM8WV8
InChIKey: MCABXKINPWWXRD-GJDJGZIVSA-N

Molecular Formula

  • C30-H37-N-O5

Molecular Weight

  • 491.6243
 
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Names and Synonyms

Results Name

  • CDB 4453

Name of Substance

  • CDB-4453

Synonyms

  • CDB 4453
  • UNII-48I9KM8WV8

Systematic Name

  • 19-Norpregna-4,9-diene-3,20-dione, 17-(acetyloxy)-21-methoxy-11-(4-(methylamino)phenyl)-, (11beta)-

Registry Numbers

CAS Registry Number

  • 365416-28-0

FDA UNII

  • 48I9KM8WV8

System Generated Number

  • 0365416280

Structure Descriptors

InChI

1S/C30H37NO5/c1-18(32)36-30(27(34)17-35-4)14-13-26-24-11-7-20-15-22(33)10-12-23(20)28(24)25(16-29(26,30)2)19-5-8-21(31-3)9-6-19/h5-6,8-9,15,24-26,31H,7,10-14,16-17H2,1-4H3/t24-,25+,26-,29-,30-/m0/s1

InChIKey

MCABXKINPWWXRD-GJDJGZIVSA-N

Smiles

C12=C3C(=CC(=O)CC3)CC[C@H]1[C@H]1[C@@]([C@@](C(=O)COC)(CC1)OC(=O)C)(C[C@@H]2c1ccc(NC)cc1)C