O-alpha-D-Glucuronopyranosyl bacteriohopanetetrol
[CAS# 144599-05-3]

Identification

• Name: O-alpha-D-Glucuronopyranosyl bacteriohopanetetrol
• Synonyms: O-Glucuronopyranosyl Bacteriohopanetetrol; O-Alpha-D-Glucuronopyranosyl Bacteriohopanetetrol
• Molecular Formula: C₄₁H₇₀O₁₀
• Molecular Weight: 723.00
• CAS Registry Number: 144599-05-3
• SMILES: [C@@]34([C@@H]([C@@]1([C@H]([C@H](CC1)[C@@H](CC[C@@H](O)[C@@H](O)[C@@H](O)CO[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)C)CC3)C)CC[C@H]5[C@]4(CC[C@@H]6[C@@]5(CCCC6(C)C)C)C)C
• InChI: 1S/C41H70O10/c1-22(9-10-25(42)30(44)26(43)21-50-36-33(47)31(45)32(46)34(51-36)35(48)49)23-13-18-38(4)24(23)14-19-40(6)28(38)11-12-29-39(5)17-8-16-37(2,3)27(39)15-20-41(29,40)7/h22-34,36,42-47H,8-21H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27+,28-,29-,30-,31+,32+,33-,34+,36+,38+,39+,40-,41-/m1/s1
• InChIKey: SSVGOKCWDNWMHB-XGFMURHTSA-N

Properties

• Density: 1.24g/cm³ (Cal.)
• Boiling point: 845.834°C at 760 mmHg (Cal.)
• Flash point: 248.909°C (Cal.)