化学式

CAS号

59202-88-9

IUPAC Name

(E)-3-(3-氨基苯基)丙-2-烯酸;14-[4-(二甲基氨基)-3-羟基-6-methyloxan-2-基]氧基-8-乙基-1-羟基-12-(5-羟基-4-甲氧基-4,6-dimethyloxan-2-基)氧基-2,7,11,13,15,17-六甲基-4,6,9,18-tetraoxatricyclo[13.2.1.03,7]十八烷-5,10-二酮 (E)-3-(3-aminophenyl)prop-2-enoic acid;14-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-8-ethyl-1-hydroxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-2,7,11,13,15,17-hexamethyl-4,6,9,18-tetraoxatricyclo[13.2.1.03,7]octadecane-5,10-dione

InChI

InChI=1S/C38H65NO14.C9H9NO2/c1-14-25-37(10)31(51-34(43)52-37)22(6)38(44)18(2)16-36(9,53-38)30(50-33-27(40)24(39(11)12)15-19(3)46-33)20(4)28(21(5)32(42)48-25)49-26-17-35(8,45-13)29(41)23(7)47-26;10-8-3-1-2-7(6-8)4-5-9(11)12/h18-31,33,40-41,44H,14-17H2,1-13H3;1-6H,10H2,(H,11,12)/b;5-4+

InChI Key

VLKNMMMMSJSKPU-RCKHEGBHSA-N

Canonical SMILES

CCC1C2(C(C(C3(C(CC(O3)(C(C(C(C(C(=O)O1)C)OC4CC(C(C(O4)C)O)(C)OC)C)OC5C(C(CC(O5)C)N(C)C)O)C)C)O)C)OC(=O)O2)C.C1=CC(=CC(=C1)N)C=CC(=O)O

别名

• 59202-88-9
• Erythromycin, 9-deoxo-6,9-epoxy-9-hydroxy-, cyclic 11,12-carbonate, (9S)-, 3-(3-aminophenyl)-2-propenoate (salt)