Methyl (1R,3S,5S,8S,9S,11R,15S,16S,17R,18S,25Z,33R,35S,36R,37S)-33-[(3-Amino-3,6-Dideoxy-beta-D-Mannopyranosyl)Oxy]-1,3,5,8,9,11,17,37-Octahydroxy-15,16,18-Trimethyl-13-Oxo-14,39-Dioxabicyclo[33.3.1]N Onatriaconta-19,21,23,25,27,29,31-Heptaene-36-Carboxylate
[CAS# 36148-89-7]

Identification

• Name: Methyl (1R,3S,5S,8S,9S,11R,15S,16S,17R,18S,25Z,33R,35S,36R,37S)-33-[(3-Amino-3,6-Dideoxy-beta-D-Mannopyranosyl)Oxy]-1,3,5,8,9,11,17,37-Octahydroxy-15,16,18-Trimethyl-13-Oxo-14,39-Dioxabicyclo[33.3.1]N Onatriaconta-19,21,23,25,27,29,31-Heptaene-36-Carboxylate
• Synonyms: Am; AMB; AME
• Molecular Formula: C₄₈H₇₅NO₁₇
• Molecular Weight: 938.11
• CAS Registry Number: 36148-89-7
• SMILES: O=C2O[C@@H](C)[C@@H](C)[C@H](O)[C@H](/C=C\C=C/C=C\C=C/C=C\C=C/C=C\[C@H](O[C@@H]1O[C@H](C)[C@@H](O)[C@H](N)[C@@H]1O)C[C@@H]3O[C@](O)(C[C@@H](O)C[C@@H](O)CC[C@H](O)[C@@H](O)C[C@@H](O)C2)C[C@H](O)[C@H]3C(=O)OC)C
• InChI: 1S/C48H75NO17/c1-28-18-16-14-12-10-8-6-7-9-11-13-15-17-19-35(65-47-45(59)42(49)44(58)31(4)64-47)25-39-41(46(60)62-5)38(55)27-48(61,66-39)26-34(52)22-32(50)20-21-36(53)37(54)23-33(51)24-40(56)63-30(3)29(2)43(28)57/h6-19,28-39,41-45,47,50-55,57-59,61H,20-27,49H2,1-5H3/b7-6-,10-8-,11-9-,14-12-,15-13-,18-16-,19-17-/t28-,29+,30-,31+,32-,33+,34-,35-,36-,37-,38-,39-,41+,42-,43+,44+,45-,47-,48+/m0/s1
• InChIKey: LALMAHYFXASBSU-VVRDBWIYSA-N

Properties

• Density: 1.314g/cm³ (Cal.)
• Boiling point: 1102.617°C at 760 mmHg (Cal.)
• Flash point: 620.64°C (Cal.)