2-[[6-[4-(hydroxymethyl)phenyl]-5-methyl-2-[3-[[2-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]ethanethioyl]amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Molecular Formula:
C41H46N2O14S2
InChI: InChI=1/C41H46N2O14S2/c1-21-33(20-59-39-30(40(49)50)10-7-15-42-39)56-41(57-35(21)27-13-11-26(18-44)12-14-27)28-8-6-9-29(16-28)43-34(58)17-31-36(52-23(3)46)38(54-25(5)48)37(53-24(4)47)32(55-31)19-51-22(2)45/h6-16,21,31-33,35-38,41,44H,17-20H2,1-5H3,(H,43,58)(H,49,50)/f/h43,49H
InChIKey: InChIKey=MOYLPEWDFWWJQT-CMAYKPFDCG
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC(=CC=C3)NC(=S)CC4C(C(C(C(O4)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)CSC5=C(C=CC=N5)C(=O)O
Names:
2-[[6-[4-(hydroxymethyl)phenyl]-5-methyl-2-[3-[[2-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]ethanethioyl]amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Registries:
PubChem CID 4084230
PubChem ID 6001052
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