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Substance Name: Gypsogenin acetate
RN: 27706-38-3
UNII: D5R6OC01IY
InChIKey: MCDYEFFAFNMJFD-PRGPMLBASA-N

Molecular Formula

  • C32-H48-O5

Molecular Weight

  • 512.7262
 
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Names and Synonyms

Name of Substance

  • Gypsogenin acetate

Synonyms

  • (3beta,4alpha)-3-Hydroxy-23-oxoolean-12-en-28-oic acid, acetate
  • Githagenin acetate
  • Gypsogenin acetate
  • Gypsogenin acetate [MI]
  • Olean-12-en-28-oic acid, 3-(acetyloxy)-23-oxo-, (3beta,4alpha)-
  • UNII-D5R6OC01IY

Registry Numbers

CAS Registry Number

  • 27706-38-3

FDA UNII

  • D5R6OC01IY

System Generated Number

  • 0027706383

Structure Descriptors

InChI

1S/C32H48O5/c1-20(34)37-25-11-12-28(4)23(29(25,5)19-33)10-13-31(7)24(28)9-8-21-22-18-27(2,3)14-16-32(22,26(35)36)17-15-30(21,31)6/h8,19,22-25H,9-18H2,1-7H3,(H,35,36)/t22-,23+,24+,25-,28-,29-,30+,31+,32-/m0/s1

InChIKey

MCDYEFFAFNMJFD-PRGPMLBASA-N

Smiles

CC(=O)O[C@H]1CC[C@]2([C@H]([C@]1(C)C=O)CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)C