Camelliagenin A
[CAS# 53227-91-1]

Identification

• Name: Camelliagenin A
• Synonyms: (3S,6Ar,6Bs,8R,8As,9S,12Ar,14Ar,14Br)-4,4,6A,6B,11,11,14B-Heptamethyl-8A-Methylol-1,2,3,4A,5,6,7,8,9,10,12,12A,14,14A-Tetradecahydropicene-3,8,9-Triol; (3Beta,16Alpha,22Alpha)-Olean-12-Ene-3,16,22,28-Tetrol; Olean-12-Ene-3,16,22,28-Tetrol, (3Beta,16Alpha,22Alpha)-
• Molecular Formula: C₃₀H₅₀O₄
• Molecular Weight: 474.72
• CAS Registry Number: 53227-91-1
• 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@@]([C@H](O)C4)([C@@H](O)CC(C5)(C)C)CO)C)C
• InChI: 1S/C30H50O4/c1-25(2)14-19-18-8-9-21-27(5)12-11-22(32)26(3,4)20(27)10-13-28(21,6)29(18,7)16-24(34)30(19,17-31)23(33)15-25/h8,19-24,31-34H,9-17H2,1-7H3/t19-,20?,21-,22+,23+,24-,27+,28-,29-,30-/m1/s1
• InChIKey: CTNHZEZBBGIUJB-YSRXEMINSA-N

Properties

• Density: 1.147g/cm³ (Cal.)
• Boiling point: 582.027°C at 760 mmHg (Cal.)
• Flash point: 238.72°C (Cal.)