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Substance Name: Euscaphic acid
RN: 53155-25-2
InChIKey: OXVUXGFZHDKYLS-SPQMEPECSA-N

Note

  • Isolated from medicinal plant, Euscaphis japonica Pax.

Molecular Formula

  • C30-H48-O5

Molecular Weight

  • 488.704
 
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Names and Synonyms

Name of Substance

  • Euscaphic acid

Synonyms

  • Jacarandic acid
  • Tormentic acid

Systematic Name

  • 2alpha,3alpha,19 alpha-Trihydroxyurs-12-en-28-oic acid

Registry Numbers

CAS Registry Number

  • 53155-25-2

System Generated Number

  • 0053155252

Structure Descriptors

InChI

1S/C30H48O5/c1-17-10-13-30(24(33)34)15-14-27(5)18(22(30)29(17,7)35)8-9-21-26(4)16-19(31)23(32)25(2,3)20(26)11-12-28(21,27)6/h8,17,19-23,31-32,35H,9-16H2,1-7H3,(H,33,34)/t17-,19-,20?,21-,22+,23-,26+,27-,28-,29-,30+/m1/s1

InChIKey

OXVUXGFZHDKYLS-SPQMEPECSA-N

Smiles

C1[C@H]([C@H](C(C)(C)[C@@H]2CC[C@@]3(C)[C@]4(C)CC[C@@]5(C(=O)O)CC[C@@H](C)[C@@](C)([C@H]5C4=CC[C@H]3[C@@]12C)O)O)O