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Substance Name: Urs-12-en-28-oic acid, 2,3-dihydroxy-, (3beta)-
RN: 72881-13-1
InChIKey: HFGSQOYIOKBQOW-OHELTNCKSA-N

Molecular Weight

  • 472.705
 
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Names and Synonyms

  • Urs-12-en-28-oic acid, 2,3-dihydroxy-, (3beta)-

Registry Numbers

CAS Registry Number

  • 72881-13-1

System Generated Number

  • 0072881131

Structure Descriptors

InChI

1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)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+/m1/s1

InChIKey

HFGSQOYIOKBQOW-OHELTNCKSA-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@@H](C)[C@H]5C4=CC[C@H]3[C@@]12C)O)O