CPD101736

Chemical Name:

(2S,3S,4R,5S,6R)-2-(3-(4-(4-((1-((2-(dimethylamino)ethyl)amino))-2-methyl-1-oxopropan-2-yl )-4-oxobutyl)benzyl)-4-methylphenyl)-6-(methylthio)tetrahydro-2H-pyran-3,4,5-triyl triacetate

SMILES Kodhi:

O=C(NC(C)(C)C(NCCN(C)C)=O)CCCC1=CC=C(CC2=CC([C@@]3([H])[C@H](OC (C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](SC)O3)=CC=C2C)C =C1

InChi Code:

InChI=1S/C38H53N3O9S/c1-23-13-18-29(32-33(47-24(2)42)34(48-25(3) 43)35(49-26(4)44)36(50-32)51-9)22-30(23)21-28-16-14-27(15-17-28) 11-10-12-31(45)40-38(5,6)37(46)39-19-20-41(7)8/h13-18,22,32-36H, 10-12,19-21H2,1-9H3,(H,39,46)(H,40,45)/t32-,33-,34+,35-,36+/m0/s1

InChi Key:

KJDSPNYKZOQKSG-OVGKCMKNSA-N

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