(1S,2R,5R,6S,7R,8R,9S,11R,15R)-8-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-2-ethyl-6-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-9-methoxy-1,5,7,9,11,14-hexamethyl-16-(3-quinolin-4-ylpropylamino)-3,18-dioxa-13,16-diazabicyclo[13.3.0]octadecane-4,12,17-trione
Molecular Formula:
C51H81N5O13
InChI: InChI=1/C51H81N5O13/c1-15-38-51(10)42(56(48(61)69-51)53-23-18-19-34-22-24-52-36-21-17-16-20-35(34)36)32(6)54-45(59)28(2)26-50(9,63-14)44(68-47-40(57)37(55(11)12)25-29(3)64-47)30(4)41(31(5)46(60)66-38)67-39-27-49(8,62-13)43(58)33(7)65-39/h16-17,20-22,24,28-33,37-44,47,53,57-58H,15,18-19,23,25-27H2,1-14H3,(H,54,59)/t28-,29-,30+,31-,32u,33+,37+,38+,39+,40-,41+,42-,43+,44-,47+,49-,50+,51-/m1/s1/f/h54H
InChIKey: InChIKey=IQODZGFGZQYTPI-WJTOCKCIDU
SMILES: CCC1C2(C(C(NC(=O)C(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)C)O)(C)OC)C)C)N(C(=O)O2)NCCCC5=CC=NC6=CC=CC=C56)C
Names:
(1S,2R,5R,6S,7R,8R,9S,11R,15R)-8-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-2-ethyl-6-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-9-methoxy-1,5,7,9,11,14-hexamethyl-16-(3-quinolin-4-ylpropylamino)-3,18-dioxa-13,16-diazabicyclo[13.3.0]octadecane-4,12,17-trione
Registries:
PubChem CID 10170236
PubChem ID 15163243
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