ErythromycinAEnolEther(33396-29-1)名称与标识符
名称
中文别名:
红霉素A烯醇醚;2,6-二氯苯-1,4-二醇;8,9-二去氢-9-去氧代-6-脱氧-6,9-环氧红霉素;红霉素杂质E(EP) 标准品;
英文别名:
Erythromycin,8,9-didehydro-9-deoxo-6-deoxy-6,9-epoxy-;Erythromycin A Enol Ether;6,9-Epoxy-8,9-didehydro-9-deoxo-6-deoxyerythromycin;6-Deoxy-9-deoxo-8,9-didehydro-6,9-epoxyerythromycin;8,9-anhydroerythromycin 6,9-hemiketal;8,9-anhydroerythromycin A;8,9-anhydroerythromycin A 6,9-hemiacetal;8,9-anhydroerythromycin A 6,9-hemiketal;9-Deoxo-6-deoxy-6,9-epoxy-8,9-didehydroerythromycin;EM 523;erythromycin hemiketal;
标识符
InChIKey:
JFVYXJKGJMUGRG-KJPZRSJGSA-N
Inchi:
1S/C37H65NO12/c1-14-25-37(10,43)30(40)20(4)28-18(2)16-36(9,50-28)32(49-34-27(39)24(38(11)12)15-19(3)45-34)21(5)29(22(6)33(42)47-25)48-26-17-35(8,44-13)31(41)23(7)46-26/h19-27,29-32,34,39-41,43H,14-17H2,1-13H3/t19-,20+,21+,22-,23+,24+,25-,26+,27-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1
SMILES:
O1C2[C@H](C)[C@H]([C@@](C)([C@@H](CC)OC([C@H](C)[C@H]([C@H](C)[C@H]([C@@]1(C)CC=2C)O[C@H]1[C@@H]([C@H](C[C@@H](C)O1)N(C)C)O)O[C@H]1C[C@](C)([C@H]([C@H](C)O1)O)OC)=O)O)O