化学式

CAS号

IUPAC Name

[(2R,3R,4S,5S,6R)-5-[[(3aS,4S,6R,7aR)-4,7a-二甲基-2-氧代-3a,4,6,7-四氢-[1,3]二氧代[4,5-c]吡喃-6-基]氧基]-4-(二甲基氨基)-2-[[(4R,5S,6S,7R,9R,11E,13E,15S,16R)-7-[(2E)-2-[(1,1-二氧代-1,4-噻嗪-4-基)亚氨基]乙基]-16-乙基-4-羟基-15-(羟甲基)-5,9,13-三甲基-2,10-二氧代-1-oxacyclohexadeca-11,13-二烯-6-基]氧基]-6-m [(2R,3R,4S,5S,6R)-5-[[(3aS,4S,6R,7aR)-4,7a-dimethyl-2-oxo-3a,4,6,7-tetrahydro-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-4-(dimethylamino)-2-[[(4R,5S,6S,7R,9R,11E,13E,15S,16R)-7-[(2E)-2-[(1,1-dioxo-1,4-thiazinan-4-yl)imino]ethyl]-16-ethyl-4-hydroxy-15-(hydroxymethyl)-5,9,13-trimethyl-2,10-dioxo-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-6-methyloxan-3-yl] acetate

InChI

InChI=1S/C45H71N3O16S/c1-11-35-32(24-49)20-25(2)12-13-33(51)26(3)21-31(14-15-46-48-16-18-65(55,56)19-17-48)39(27(4)34(52)22-36(53)60-35)62-43-41(59-30(7)50)38(47(9)10)40(28(5)58-43)61-37-23-45(8)42(29(6)57-37)63-44(54)64-45/h12-13,15,20,26-29,31-32,34-35,37-43,49,52H,11,14,16-19,21-24H2,1-10H3/b13-12+,25-20+,46-15+/t26-,27+,28-,29+,31+,32+,34-,35-,37-,38+,39-,40-,41-,42+,43+,45-/m1/s1

InChI Key

GANDGWYTHYFNPL-VYSXFQJGSA-N

Canonical SMILES

CCC1C(C=C(C=CC(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)OC3CC4(C(C(O3)C)OC(=O)O4)C)N(C)C)OC(=O)C)CC=NN5CCS(=O)(=O)CC5)C)C)CO

别名