4-[[2-[4-[2-[(3-carboxypropanoylamino)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Molecular Formula:
C36H35NO8S
InChI: InChI=1/C36H35NO8S/c38-21-23-5-7-25(8-6-23)32-19-29(22-46-30-15-13-26(14-16-30)35(42)43)44-36(45-32)27-11-9-24(10-12-27)31-4-2-1-3-28(31)20-37-33(39)17-18-34(40)41/h1-16,29,32,36,38H,17-22H2,(H,37,39)(H,40,41)(H,42,43)/f/h37,40,42H
InChIKey: InChIKey=TXHHNOICGSETQD-PZUQPWTRCX
SMILES: C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC=CC=C4CNC(=O)CCC(=O)O)CSC5=CC=C(C=C5)C(=O)O
Names:
4-[[2-[4-[2-[(3-carboxypropanoylamino)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Registries:
PubChem CID 4111606
PubChem ID 6037504
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