2-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[[[2-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]ethanethioyl]amino]methyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Molecular Formula:
C41H46N2O14S2
InChI: InChI=1/C41H46N2O14S2/c1-22(45)51-20-34-37(53-24(3)47)38(54-25(4)48)36(52-23(2)46)33(56-34)17-35(58)43-18-26-7-13-29(14-8-26)41-55-30(21-59-39-31(40(49)50)6-5-15-42-39)16-32(57-41)28-11-9-27(19-44)10-12-28/h5-15,30,32-34,36-38,41,44H,16-21H2,1-4H3,(H,43,58)(H,49,50)/f/h43,49H
InChIKey: InChIKey=HLDYRVHBLUMHSV-CMAYKPFDCK
SMILES: CC(=O)OCC1C(C(C(C(O1)CC(=S)NCC2=CC=C(C=C2)C3OC(CC(O3)C4=CC=C(C=C4)CO)CSC5=C(C=CC=N5)C(=O)O)OC(=O)C)OC(=O)C)OC(=O)C
Names:
2-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[[[2-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]ethanethioyl]amino]methyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Registries:
PubChem CID 4098184
PubChem ID 6019526
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