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Substance Name: Condurangamine B
RN: 55785-27-8
UNII: 0P6X30QT8M
InChIKey: YXVMXCMMJVQPPS-HIGGUUCMSA-N

Molecular Formula

  • C27-H39-N-O6

Molecular Weight

  • 473.6061
 
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Names and Synonyms

Name of Substance

  • Condurangamine B

Synonyms

  • Condurangamine B
  • Pregnane-3,11,12,14,20-pentol, 20-(3-pyridinecarboxylate), (3beta,5alpha,11alpha,12beta,14beta)-
  • UNII-0P6X30QT8M

Registry Numbers

CAS Registry Number

  • 55785-27-8

FDA UNII

  • 0P6X30QT8M

System Generated Number

  • 0055785278

Structure Descriptors

InChI

1S/C27H39NO6/c1-15(34-24(32)16-5-4-12-28-14-16)19-9-11-27(33)20-7-6-17-13-18(29)8-10-25(17,2)21(20)22(30)23(31)26(19,27)3/h4-5,12,14-15,17-23,29-31,33H,6-11,13H2,1-3H3/t15?,17-,18-,19+,20+,21+,22-,23+,25-,26-,27-/m0/s1

InChIKey

YXVMXCMMJVQPPS-HIGGUUCMSA-N

Smiles

CC(OC(=O)c1cccnc1)[C@H]2CC[C@]3(O)[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4[C@H](O)[C@@H](O)[C@]23C