2-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[[2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Molecular Formula:
C41H40N2O8S2
InChI: InChI=1/C41H40N2O8S2/c1-27-14-20-34(21-15-27)53(48,49)43-36(22-28-8-3-2-4-9-28)39(45)42-32-11-7-10-31(23-32)41-50-33(26-52-38-13-6-5-12-35(38)40(46)47)24-37(51-41)30-18-16-29(25-44)17-19-30/h2-21,23,33,36-37,41,43-44H,22,24-26H2,1H3,(H,42,45)(H,46,47)/f/h42,46H
InChIKey: InChIKey=JIJCXHQYMPZKNB-UNQFHFHNCV
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C4OC(CC(O4)C5=CC=C(C=C5)CO)CSC6=CC=CC=C6C(=O)O
Names:
2-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[[2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoyl]amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Registries:
PubChem CID 4461852
PubChem ID 6577842
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