3-Epimaslinic acid

Datasheet MSDS
Catalog Number
ANC05118
Product Name
3-Epimaslinic acid
Structure
3-Epimaslinic acid
CAS Number
26563-68-8
IUPAC Name
(4aS,6aR,6aS,6bR,10S,11R,12aR,14bR)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Synonyms
2,3-Dihydroxy-12-oleanen-28-oicacid
Molecular Formula
C30H48O4
Molecular Weight
472.7
Appearance
Powder
Purity
>95%
SMILES
C[C@@]12CCC3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@@H]4CC(CC5)(C)C)C(=O)O)C)(C[C@H]([C@H](C3(C)C)O)O)C
InChI
InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21?,22-,23-,27+,28-,29-,30+/m1/s1
InChI Key
MDZKJHQSJHYOHJ-LJJNEPIXSA-N
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