21-O-Acetyl-16-Hydroxystreptovaricinoic Acid Methyl Ester
[CAS# 23344-16-3]

Identification

• Name: 21-O-Acetyl-16-Hydroxystreptovaricinoic Acid Methyl Ester
• Synonyms: 6,9:23,24A-Dimethano-24Ah-M-Dioxino[4,5,6-St][4]Benzazacycloheneicosine-7,11,26(10H,16H)-Trione, 17,18,19,20,21,22,23,24-Octahydro-5,16,17,19,20,21,25-Heptahydroxy-24-(2-Hydroxypropenyl)-23-Methoxy-4,8,12,16,18,22,24-Heptamethyl-, 21,24-Diacetate; 6,9:23,24A-Dimethano-24Ah-M-Dioxino[4,5,6-St][4]Benzazacycloheneicosine-7,11,26(10H,16H)-Trione, 17,18,19,20,21,22,23,24-Octahydro-5,16,17,19,20,21,25-Heptahydroxy-24-(2-Hydroxypropenyl)-23-Methoxy-4,8,12,16,18,22,24-Heptamethyl-,21,24-Diacetate; Nsc48810
• Molecular Formula: C₄₂H₅₃NO₁₆
• Molecular Weight: 827.88
• CAS Registry Number: 23344-16-3
• SMILES: [C@@H]1([C@H](OC(=O)C)[C@@H]([C@@H](O)[C@@](O)(C)\C=C(C4=C3C2=C(OC(=O)C)C(=C(NC(=O)C(=C\C=C/[C@](O)([C@@H](O)[C@H]([C@H]1O)C)C)\C)C(=O)C2=C(O)C(=C3OCO4)C)C)\C)C)C(OC)=O
• InChI: 1S/C42H53NO16/c1-17-13-12-14-41(9,53)37(49)21(5)31(47)28(40(52)55-11)36(59-24(8)45)22(6)38(50)42(10,54)15-18(2)33-27-25-26(30(46)20(4)34(27)57-16-56-33)32(48)29(43-39(17)51)19(3)35(25)58-23(7)44/h12-15,21-22,28,31,36-38,46-47,49-50,53-54H,16H2,1-11H3,(H,43,51)/b14-12-,17-13+,18-15-/t21-,22-,28+,31+,36+,37-,38+,41-,42+/m0/s1
• InChIKey: AECSSEUNGBWEHU-BPGRRABJSA-N