Rhizochaline
[CAS# 125342-59-8]

Identification

• Name: Rhizochaline
• Synonyms: 2,27-Diamino-3-Hydroxy-26-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Octacosan-11-One; 2,27-Diamino-3-Hydroxy-26-[[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Octacosan-11-One; 2,27-Diamino-3-Hydroxy-26-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Octacosan-11-One
• Molecular Formula: C₃₄H₆₈N₂O₈
• Molecular Weight: 632.92
• CAS Registry Number: 125342-59-8
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@H]([C@H](O1)CO)O)O)OC(C(N)C)CCCCCCCCCCCCCCC(=O)CCCCCCCC(C(N)C)O
• InChI: 1S/C34H68N2O8/c1-25(35)28(39)22-18-14-11-13-17-21-27(38)20-16-12-9-7-5-3-4-6-8-10-15-19-23-29(26(2)36)43-34-33(42)32(41)31(40)30(24-37)44-34/h25-26,28-34,37,39-42H,3-24,35-36H2,1-2H3/t25?,26?,28?,29?,30-,31+,32+,33-,34-/m1/s1
• InChIKey: JVNAFTWQOXCOPF-SDAVCUDKSA-N

Properties

• Density: 1.106g/cm³ (Cal.)
• Boiling point: 788.18°C at 760 mmHg (Cal.)
• Flash point: 430.476°C (Cal.)