Amphoteronolide B
[CAS# 106799-07-9]

Identification

• Name: Amphoteronolide B
• Synonyms: 14,39-Dioxabicyclo(33.3.1)nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid, 1,3,5,6,9,11,17,33,37-nonahydroxy-15,16,18-trimethyl-13-oxo-, (1R-(1R*,3S*,5R*,6R*,9R*,11R*,15S*,16R*,17R*,18S*,19E,21E,23E,25E,27E,29E,31E,33R*,35S*,36R*,37S*))-; Amphotericin B aglycone
• Molecular Formula: C₄₁H₆₂O₁₄
• Molecular Weight: 778.92
• CAS Registry Number: 106799-07-9
• SMILES: O=C1O[C@@H](C)[C@H](C)[C@H](O)[C@H](C=CC=CC=CC=CC=CC=CC=C[C@H](O)C[C@@H]2O[C@](O)(C[C@@H](O)C[C@@H](O)[C@H](O)CC[C@@H](O)C[C@@H](O)C1)C[C@H](O)[C@H]2C(=O)O)C
• InChI: 1S/C41H62O14/c1-26-16-14-12-10-8-6-4-5-7-9-11-13-15-17-29(42)22-36-38(40(51)52)35(48)25-41(53,55-36)24-32(45)21-34(47)33(46)19-18-30(43)20-31(44)23-37(49)54-28(3)27(2)39(26)50/h4-17,26-36,38-39,42-48,50,53H,18-25H2,1-3H3,(H,51,52)/t26-,27-,28-,29-,30+,31+,32-,33+,34+,35-,36-,38+,39+,41+/m0/s1
• InChIKey: VOPKRGFUUMVSHY-ZQCSYNFZSA-N

Properties

• Density: 1.209g/cm³ (Cal.)
• Boiling point: 1038.996°C at 760 mmHg (Cal.)
• Flash point: 308.425°C (Cal.)
• Refractive index: 1.545 (Cal.)