2-[[2-[4-[3-[(3-carboxypropanoylamino)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Molecular Formula:
C36H36N2O8S
InChI: InChI=1/C36H36N2O8S/c1-22-30(21-47-34-29(35(43)44)6-3-17-37-34)45-36(46-33(22)26-9-7-23(20-39)8-10-26)27-13-11-25(12-14-27)28-5-2-4-24(18-28)19-38-31(40)15-16-32(41)42/h2-14,17-18,22,30,33,36,39H,15-16,19-21H2,1H3,(H,38,40)(H,41,42)(H,43,44)/f/h38,41,43H
InChIKey: InChIKey=UJNMCJQVVZZFIE-JNLIDKADCQ
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CNC(=O)CCC(=O)O)CSC5=C(C=CC=N5)C(=O)O
Names:
2-[[2-[4-[3-[(3-carboxypropanoylamino)methyl]phenyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Registries:
PubChem CID 4117583
PubChem ID 6045584
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