化学式

CAS号

IUPAC Name

(3aR,4R,6R,8R,9R,10R,12S,15S,15aR)-9-[(2S,3R,4S,5S,6R)-4-(二甲基氨基)-3-羟基-5-[4-(1-羟基己基)三唑-1-基]-6-methyloxan-2-基]氧基-15-乙基-8-甲氧基-4,6,8,10,12,15a-六甲基-3a,4,6,7,9,10,14,15-octahydrocyclotetradeca[d][1,3]间二氧杂环戊烯-2,5,11,13-四酮 (3aR,4R,6R,8R,9R,10R,12S,15S,15aR)-9-[(2S,3R,4S,5S,6R)-4-(dimethylamino)-3-hydroxy-5-[4-(1-hydroxyhexyl)triazol-1-yl]-6-methyloxan-2-yl]oxy-15-ethyl-8-methoxy-4,6,8,10,12,15a-hexamethyl-3a,4,6,7,9,10,14,15-octahydrocyclotetradeca[d][1,3]dioxole-2,5,11,13-tetrone

InChI

InChI=1S/C40H66N4O11/c1-13-15-16-17-28(45)27-20-44(42-41-27)30-25(7)52-37(34(49)31(30)43(10)11)53-35-24(6)33(48)22(4)29(46)18-26(14-2)40(9)36(54-38(50)55-40)23(5)32(47)21(3)19-39(35,8)51-12/h20-26,28,30-31,34-37,45,49H,13-19H2,1-12H3/t21-,22+,23+,24+,25-,26+,28?,30-,31+,34-,35-,36-,37+,39-,40-/m1/s1

InChI Key

NPNXARIHTALDLI-YQKDPRRDSA-N

Canonical SMILES

CCCCCC(C1=CN(N=N1)C2C(OC(C(C2N(C)C)O)OC3C(C(=O)C(C(=O)CC(C4(C(C(C(=O)C(CC3(C)OC)C)C)OC(=O)O4)C)CC)C)C)C)O

别名

• (1R,2R,4R,6R,7R,8R,10S,13S,14R)-7-[[(2S)-3alpha-Hydroxy-4beta-(dimethylamino)-5alpha-[4-(1-hydroxyhexyl)-1H-1,2,3-triazole-1-yl]-6beta-methyl-tetrahydro-2H-pyran-2beta-yl]oxy]-6-methoxy-13-ethyl-2,4,6,8,10,14-hexamethyl-15,17-dioxabicyclo[12.3.0]heptadecane-3,9,11,16-tetraone