HIT ID: HIT218695558

Cas No: 149017-66-3

分子式: C14H14N3O12PS2

分子量: 511.37

常用名: 4-(2-{4-formyl-5-hydroxy-6-methyl-3-[(phosphonooxy)methyl]pyridin-2-yl}diazen-1-yl)benzene-1,3-disulfonic acid, PPADS

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 4-(2-{4-formyl-5-hydroxy-6-methyl-3-[(phosphonooxy)methyl]pyridin-2-yl}diazen-1-yl)benzene-1,3-disulfonic acid

SMILES: Cc1nc(N=Nc2ccc(cc2S(O)(=O)=O)S(O)(=O)=O)c(COP(O)(O)=O)c(C=O)c1O

InChI key: PNFZSRRRZNXSMF-UHFFFAOYSA-N