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Substance Name: Triptotriterpenic acid C
RN: 123914-32-9
InChIKey: IWVWTVWLRSUYNC-ULUYBTNLSA-N

Note

  • Isolated from Tripterygium wilfordii.

Molecular Formula

  • C30-H48-O4

Molecular Weight

  • 472.705
 
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Names and Synonyms

Name of Substance

  • Triptotriterpenic acid C

Synonym

  • 3,22-Dihydroxyurs-12-en-30-oic acid

Systematic Name

  • Urs-12-en-30-oic acid, 3,22-dihydroxy-, (3beta,22alpha)-

Registry Numbers

CAS Registry Number

  • 123914-32-9

System Generated Number

  • 0123914329

Structure Descriptors

InChI

1S/C30H48O4/c1-17-18(25(33)34)16-23(32)28(5)14-15-29(6)19(24(17)28)8-9-21-27(4)12-11-22(31)26(2,3)20(27)10-13-30(21,29)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20?,21+,22-,23-,24+,27-,28-,29+,30+/m0/s1

InChIKey

IWVWTVWLRSUYNC-ULUYBTNLSA-N

Smiles

C1[C@@H](C(C)(C)[C@@H]2CC[C@@]3(C)[C@]4(C)CC[C@@]5(C)[C@H](C[C@@H](C(=O)O)[C@@H](C)[C@H]5C4=CC[C@H]3[C@@]2(C1)C)O)O