3,22-Dihydroxyurs-12-en-30-oic acid
[CAS# 123914-32-9]

Identification

• Name: 3,22-Dihydroxyurs-12-en-30-oic acid
• Synonyms: 3,22-Dihydroxyurs-12-En-30-Oic Acid; Urs-12-En-30-Oic Acid, 3,22-Dihydroxy-, (3Beta,22Alpha)-
• Molecular Formula: C₃₀H₄₈O₄
• Molecular Weight: 472.71
• CAS Registry Number: 123914-32-9
• SMILES: [C@@]13([C@]4(C(=CC[C@@H]1[C@@]2(C(C([C@@H](O)CC2)(C)C)CC3)C)[C@@H]5[C@@](CC4)([C@@H](O)C[C@H]([C@@H]5C)C(=O)O)C)C)C
• InChI: 1S/C30H48O4/c1-17-18(25(33)34)16-23(32)28(5)14-15-29(6)19(24(17)28)8-9-21-27(4)12-11-22(31)26(2,3)20(27)10-13-30(21,29)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+/m0/s1
• InChIKey: IWVWTVWLRSUYNC-ULUYBTNLSA-N

Properties

• Density: 1.143g/cm³ (Cal.)
• Boiling point: 587.511°C at 760 mmHg (Cal.)
• Flash point: 323.152°C (Cal.)