2-[[2-(3-acetamidophenyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid

Molecular Formula: C27H27NO6S


InChI: InChI=1/C27H27NO6S/c1-17(30)28-21-6-4-5-20(13-21)27-33-22(16-35-25-8-3-2-7-23(25)26(31)32)14-24(34-27)19-11-9-18(15-29)10-12-19/h2-13,22,24,27,29H,14-16H2,1H3,(H,28,30)(H,31,32)/f/h28,31H

InChIKey: InChIKey=JEHKWFRNUWAFNZ-PVANZQSZCA
SMILES: CC(=O)NC1=CC=CC(=C1)C2OC(CC(O2)C3=CC=C(C=C3)CO)CSC4=CC=CC=C4C(=O)O

Names:
    2-[[2-(3-acetamidophenyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid

Registries:
    PubChem CID 3571951
    PubChem ID 4839746