4-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[3-[[[2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoyl]amino]methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Molecular Formula:
C48H46N2O8S2
InChI: InChI=1/C48H46N2O8S2/c1-32-13-23-43(24-14-32)60(55,56)50-44(26-33-7-3-2-4-8-33)46(52)49-29-35-9-5-10-38(25-35)39-11-6-12-40(27-39)48-57-41(31-59-42-21-19-37(20-22-42)47(53)54)28-45(58-48)36-17-15-34(30-51)16-18-36/h2-25,27,41,44-45,48,50-51H,26,28-31H2,1H3,(H,49,52)(H,53,54)/f/h49,53H
InChIKey: InChIKey=MSLJDCVXCZULRP-VVCOJILZCR
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NCC3=CC=CC(=C3)C4=CC(=CC=C4)C5OC(CC(O5)C6=CC=C(C=C6)CO)CSC7=CC=C(C=C7)C(=O)O
Names:
4-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[3-[[[2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoyl]amino]methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Registries:
PubChem CID 4083630
PubChem ID 6000237
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