化学式

CAS号

IUPAC Name

(1R,2R,5R,6S,7S,8R,9R,11R,14R,15R)-2-乙基-9-羟基-6-[(2R,4R,5S,6S)-5-羟基-4-甲氧基-4,6-dimethyloxan-2-基]氧基-8-[(2S,3R,4S,6R)-3-羟基-6-甲基-4-[甲基-[2-[1-[2-(4-甲基苯基)乙基]三唑-4-基]乙基]氨基]四氢吡喃-2-基]氧基-1,5,7,9,11,13,14-庚甲基-3,16,18-三氧杂-13-氮杂双环[13.3.0]十八烷-4,17-二酮 (1R,2R,5R,6S,7S,8R,9R,11R,14R,15R)-2-ethyl-9-hydroxy-6-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-8-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-[methyl-[2-[1-[2-(4-methylphenyl)ethyl]triazol-4-yl]ethyl]amino]oxan-2-yl]oxy-1,5,7,9,11,13,14-heptamethyl-3,16,18-trioxa-13-azabicyclo[13.3.0]octadecane-4,17-dione

InChI

InChI=1S/C51H83N5O13/c1-15-39-51(11)45(68-48(60)69-51)34(7)55(13)27-30(3)25-49(9,61)44(32(5)42(33(6)46(59)65-39)66-40-26-50(10,62-14)43(58)35(8)64-40)67-47-41(57)38(24-31(4)63-47)54(12)22-21-37-28-56(53-52-37)23-20-36-18-16-29(2)17-19-36/h16-19,28,30-35,38-45,47,57-58,61H,15,20-27H2,1-14H3/t30-,31-,32+,33-,34-,35+,38+,39-,40+,41-,42+,43+,44-,45-,47+,49-,50-,51-/m1/s1

InChI Key

HVALDGCZXDLZFF-COSBRTTOSA-N

Canonical SMILES

CCC1C2(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC3CC(C(C(O3)C)O)(C)OC)C)OC4C(C(CC(O4)C)N(C)CCC5=CN(N=N5)CCC6=CC=C(C=C6)C)O)(C)O)C)C)C)OC(=O)O2)C

别名

• SCHEMBL16790570