Septamycin Sodium Salt
[CAS# 55924-40-8]

Identification

• Name: Septamycin Sodium Salt
• Synonyms: Sodium 2-[2-Hydroxy-6-[[2-[5-[5-(6-Hydroxy-3,5,6-Trimethyl-Tetrahydropyran-2-Yl)Tetrahydrofuran-2-Yl]Tetrahydrofuran-2-Yl]-3,9-Dimethoxy-2,4,10-Trimethyl-1,6-Dioxaspiro[4.5]Decan-7-Yl]Methyl]-4-Methoxy-5-(5-Methoxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-3,5-Dimethyl-Tetrahydropyran-2-Yl]Propanoate; Sodium 2-[2-Hydroxy-6-[[2-[5-[5-(6-Hydroxy-3,5,6-Trimethyl-2-Tetrahydropyranyl)-2-Tetrahydrofuranyl]-2-Tetrahydrofuranyl]-3,9-Dimethoxy-2,4,10-Trimethyl-1,6-Dioxaspiro[4.5]Decan-7-Yl]Methyl]-4-Methoxy-5-[(5-Methoxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-3,5-Dimethyl-2-Tetrahydropyranyl]Propanoate; Sodium 2-[2-Hydroxy-6-[[2-[5-[5-(6-Hydroxy-3,5,6-Trimethyl-Tetrahydropyran-2-Yl)Tetrahydrofuran-2-Yl]Tetrahydrofuran-2-Yl]-3,9-Dimethoxy-2,4,10-Trimethyl-1,6-Dioxaspiro[4.5]Decan-7-Yl]Methyl]-4-Methoxy-5-(5-Methoxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-3,5-Dimethyl-Tetrahydropyran-2-Yl]Propionate
• Molecular Formula: C₄₈H₈₁NaO₁₆
• Molecular Weight: 937.15
• CAS Registry Number: 55924-40-8 (54927-63-8)
• SMILES: C(C5OC1(OC(C(OC)C1C)(C2OC(CC2)C3OC(CC3)C4OC(O)(C(CC4C)C)C)C)C(C(OC)C5)C)C6OC(O)(C(C(OC)C6(OC7OC(C(OC)CC7)C)C)C)C(C([O-])=O)C.[Na+]
• InChI: 1S/C48H82O16.Na/c1-24-21-25(2)46(10,51)63-40(24)35-16-15-33(58-35)34-17-19-37(59-34)45(9)42(56-14)28(5)48(64-45)26(3)36(54-12)22-31(60-48)23-38-44(8,62-39-20-18-32(53-11)30(7)57-39)41(55-13)27(4)47(52,61-38)29(6)43(49)50;/h24-42,51-52H,15-23H2,1-14H3,(H,49,50);/q;+1/p-1
• InChIKey: SIIORNJHEWQPHB-UHFFFAOYSA-M

Properties

• Boiling point: 883.4°C at 760 mmHg (Cal.)
• Flash point: 244°C (Cal.)