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Substance Name: Arjunic acid
RN: 31298-06-3
InChIKey: WDPNZZSUCIZMSX-ZKFZOLPESA-N

Note

  • From Terminalia arjuna.

Molecular Formula

  • C30-H48-O5

Molecular Weight

  • 488.704
 
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Names and Synonyms

Results Name

  • Arjunic acid

Synonym

  • Arjunic acid

Systematic Name

  • Olean-12-en-28-oic acid, 2,3,19-trihydroxy-, (2alpha,3beta,19alpha)-

Registry Numbers

CAS Registry Number

  • 31298-06-3

Other Registry Number

  • 11032-62-5

System Generated Number

  • 0031298063

Structure Descriptors

InChI

1S/C30H48O5/c1-25(2)11-13-29(24(34)35)14-12-27(5)18(19(29)15-25)7-8-22-28(27,6)10-9-21-26(3,4)23(33)20(32)16-30(21,22)17-31/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35)/t19-,20-,21?,22+,23+,27-,28-,29+,30-/m1/s1

InChIKey

WDPNZZSUCIZMSX-ZKFZOLPESA-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)CCC(C)(C)C[C@H]5C4=CC[C@H]3[C@@]12CO)O)O