(28E)-2-[2,10-Bis(sulfooxy)undecyl]-30-oxooxacyclotriacont-28-ene-14,16-diyl bis(hydrogen sulfate)
[CAS# 85756-56-5]

Identification

• Name: (28E)-2-[2,10-Bis(sulfooxy)undecyl]-30-oxooxacyclotriacont-28-ene-14,16-diyl bis(hydrogen sulfate)
• Synonyms: 30-(2,10-Bis(sulfooxy)undecyl)-16,18-bis(sulfooxy)oxacyclotriacont-3-en-2-one; Antibiotic MG 299A; MG 299-A
• Molecular Formula: C₄₀H₇₆O₁₈S₄
• Molecular Weight: 973.28
• CAS Registry Number: 85756-56-5
• SMILES: O=S(=O)(O)OC(C)CCCCCCCC(OS(=O)(=O)O)CC1OC(=O)\C=C\CCCCCCCCCCCC(OS(=O)(=O)O)CC(OS(=O)(=O)O)CCCCCCCCCCC1
• InChI: 1S/C40H76O18S4/c1-35(55-59(42,43)44)27-21-15-14-19-25-29-37(56-60(45,46)47)33-36-28-22-16-10-7-5-8-12-18-24-31-39(58-62(51,52)53)34-38(57-61(48,49)50)30-23-17-11-6-3-2-4-9-13-20-26-32-40(41)54-36/h26,32,35-39H,2-25,27-31,33-34H2,1H3,(H,42,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)/b32-26+
• InChIKey: WHOLNYBWJNOKGN-HMZBKAONSA-N

Properties

• Density: 1.303g/cm³ (Cal.)