28-Hydroxy-3-Oxoolean-12-En-29-Oic Acid
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28-Hydroxy-3-Oxoolean-12-En-29-Oic Acid

CAS 381691-22-1
IUPAC Name (4aR,6aR,6aS,6bR,12aR,14bR)-4a-(hydroxymethyl)-2,6a,6b,9,9,12a-hexamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-2-carboxylic acid
Molecular Weight 470.68
Molecular Formula C30H46O4
Canonical SMILES C[C@]12CCC(=O)C(C1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@@H]4CC(CC5)(C)C(=O)O)CO)C)C)(C)C
InChI InChI=1S/C30H46O4/c1-25(2)21-9-12-29(6)22(27(21,4)11-10-23(25)32)8-7-19-20-17-26(3,24(33)34)13-15-30(20,18-31)16-14-28(19,29)5/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21?,22-,26?,27+,28-,29-,30-/m1/s1
InChI Key HVLPFRAXQYBRJO-XVGWCWNZSA-N
Purity 98%
Appearance Solid

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