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Substance Name: Bufalin 3-hemisuccinate
RN: 60617-83-6
InChIKey: OYIGRQUNGJYTTR-FMOATVMESA-N

Molecular Formula

  • C28-H38-O7

Molecular Weight

  • 486.6012
 
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Names and Synonyms

Results Name

  • Bufalin 3-hemisuccinate

Synonyms

  • Bufalin 3-hemisuccinate
  • Bufalin, 3-hemisuccinate
  • Bufalin-3-hemisuccinate
  • NSC 234668

Systematic Name

  • 3-((3-Carboxypropanoyl)oxy)-14-hydroxybufa-20,22-dienolide

Registry Numbers

CAS Registry Number

  • 60617-83-6

System Generated Number

  • 0060617836

Structure Descriptors

InChI

1S/C28H38O7/c1-26-12-9-19(35-25(32)8-6-23(29)30)15-18(26)4-5-22-21(26)10-13-27(2)20(11-14-28(22,27)33)17-3-7-24(31)34-16-17/h3,7,16,18-22,33H,4-6,8-15H2,1-2H3,(H,29,30)/t18-,19+,20-,21+,22-,26+,27-,28+/m1/s1

InChIKey

OYIGRQUNGJYTTR-FMOATVMESA-N

Smiles

c1([C@@H]2[C@@]3([C@@]([C@@H]4[C@@H]([C@@]5(CC[C@@H](OC(=O)CCC(=O)O)C[C@@H]5CC4)C)CC3)(CC2)O)C)coc(cc1)=O