Arborinol B
[CAS# 5532-41-2]

Identification

• Name: Arborinol B
• Synonyms: D:C-Friedo-B':A'-Neogammacer-9(11)-En-3-Ol, (3Beta,8Beta,13Beta,14Alpha,17Beta,18Alpha,21Beta)-; 3Beta-Arborinol; Arborinol B
• Molecular Formula: C₃₀H₅₀O
• Molecular Weight: 426.72
• CAS Registry Number: 5532-41-2
• SMILES: [C@]14([C@](C3C(=CC1)[C@@]2(C(C([C@@H](CC2)O)(C)C)CC3)C)(CC[C@@]5(C4CC[C@H]5C(C)C)C)C)C
• InChI: 1S/C30H50O/c1-19(2)20-9-12-24-28(20,6)17-18-29(7)22-10-11-23-26(3,4)25(31)14-15-27(23,5)21(22)13-16-30(24,29)8/h13,19-20,22-25,31H,9-12,14-18H2,1-8H3/t20-,22?,23?,24?,25+,27+,28-,29-,30+/m0/s1
• InChIKey: VWYANPOOORUCFJ-TZKWAJHPSA-N

Properties

• Density: 1.012g/cm³ (Cal.)
• Boiling point: 493.346°C at 760 mmHg (Cal.)
• Flash point: 218.438°C (Cal.)