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Substance Name: Wilforlide B
RN: 84104-70-1
InChIKey: SNNNDALPPUPEKW-RSWVLDSRSA-N

Note

  • From Tripterygium regelii; Chinese medicinal plant extract.

Molecular Formula

  • C30-H44-O3

Molecular Weight

  • 452.675
 
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Names and Synonyms

Name of Substance

  • Wilforlide B

Systematic Name

  • Olean-12-en-29-oic acid, 22-hydroxy-3-oxo-, gamma-lactone, (20alpha,22alpha)-

Registry Numbers

CAS Registry Number

  • 84104-70-1

System Generated Number

  • 0084104701

Structure Descriptors

InChI

1S/C30H44O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-21,23H,9-17H2,1-7H3/t19-,20-,21+,23+,26+,27+,28-,29+,30+/m0/s1

InChIKey

SNNNDALPPUPEKW-RSWVLDSRSA-N

Smiles

C1(CC[C@@]2([C@H]3CC=C4[C@@H]5C[C@@]6(C[C@@H]([C@@]5(CC[C@@]4([C@@]3(CC[C@@H]2C1(C)C)C)C)C)OC6=O)C)C)=O