4-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[3-[[(1-methoxycarbonyl-2-phenyl-ethyl)carbamoylamino]methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Molecular Formula:
C43H42N2O8S
InChI: InChI=1/C43H42N2O8S/c1-51-41(49)38(23-28-6-3-2-4-7-28)45-43(50)44-25-30-8-5-9-35(22-30)31-14-16-34(17-15-31)42-52-36(27-54-37-20-18-33(19-21-37)40(47)48)24-39(53-42)32-12-10-29(26-46)11-13-32/h2-22,36,38-39,42,46H,23-27H2,1H3,(H,47,48)(H2,44,45,50)/f/h44-45,47H
InChIKey: InChIKey=CNXRTEGUQUASSH-NLRCAPKUCU
SMILES: COC(=O)C(CC1=CC=CC=C1)NC(=O)NCC2=CC=CC(=C2)C3=CC=C(C=C3)C4OC(CC(O4)C5=CC=C(C=C5)CO)CSC6=CC=C(C=C6)C(=O)O
Names:
4-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[3-[[(1-methoxycarbonyl-2-phenyl-ethyl)carbamoylamino]methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Registries:
PubChem CID 4451544
PubChem ID 6562756
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