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Substance Name: Virgatic acid
RN: 14356-51-5
UNII: 7K3293BNX3
InChIKey: IZWBODJDDBCDFA-DXEZAUPJSA-N

Note

  • From the roots of Salvia caespitosa (Lamiaceae).

Molecular Formula

  • C30-H46-O4

Molecular Weight

  • 470.6894
 
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Names and Synonyms

Name of Substance

  • Virgatic acid

Synonyms

  • Momordic acid
  • Olean-12-en-28-oic acid, 3-hydroxy-1-oxo-, (3beta)-
  • Olean-12-en-28-oic acid, 3beta-hydroxy-1-oxo-
  • UNII-7K3293BNX3
  • Vergatic acid
  • Virgatic acid

Registry Numbers

CAS Registry Number

  • 14356-51-5

FDA UNII

  • 7K3293BNX3

System Generated Number

  • 0014356515

Structure Descriptors

InChI

1S/C30H46O4/c1-25(2)12-14-30(24(33)34)15-13-27(5)18(19(30)17-25)8-9-21-28(27,6)11-10-20-26(3,4)22(31)16-23(32)29(20,21)7/h8,19-22,31H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21-,22-,27+,28+,29-,30-/m0/s1

InChIKey

IZWBODJDDBCDFA-DXEZAUPJSA-N

Smiles

C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)(C(=O)C[C@@H](C3(C)C)O)C