3,22-Dihydroxyolean-12-en-29-oic acid
[CAS# 100897-87-8]

Identification

• Name: 3,22-Dihydroxyolean-12-en-29-oic acid
• Synonyms: 3,22-Dihydroxyolean-12-En-29-Oic Acid; Olean-12-En-29-Oic Acid, 3,22-Dihydroxy-, (3Beta,22Alpha)-
• Molecular Formula: C₃₀H₄₈O₄
• Molecular Weight: 472.71
• CAS Registry Number: 100897-87-8
• SMILES: [C@@]23([C@@H]([C@@]1([C@H](C([C@@H](O)CC1)(C)C)CC2)C)CC=C4[C@]3(CC[C@@]5([C@H]4CC(C[C@@H]5O)(C(=O)O)C)C)C)C
• InChI: 1S/C30H48O4/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3,24(33)34)17-23(32)27(19,4)14-15-29(18,30)6/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21+,22-,23-,26?,27+,28-,29+,30+/m0/s1
• InChIKey: JTBGJQZJEYVBJZ-NRTDWLMYSA-N

Properties

• Density: 1.145g/cm³ (Cal.)
• Boiling point: 584.073°C at 760 mmHg (Cal.)
• Flash point: 321.075°C (Cal.)