HIT ID: HIT212522630
Cas No: ng
分子式: C19H18N4O7
分子量: 414.374
常用名: Futalosine
氢键受体数 (HBA): 10
氢键供体数 (HBD): 4
LogP: 0.54
IUPAC: 3-{3-[3,4-dihydroxy-5-(6-hydroxy-9H-purin-9-yl)oxolan-2-yl]propanoyl}benzoic acid
IUPAC: 3-{3-[3,4-dihydroxy-5-(6-hydroxy-9H-purin-9-yl)oxolan-2-yl]propanoyl}benzoic acid
SMILES: OC1C(CCC(=O)c2cccc(c2)C(O)=O)OC(C1O)n1cnc2c(O)ncnc12
SMILES: OC1C(CCC(=O)c2cccc(c2)C(O)=O)OC(C1O)n1cnc2c(O)ncnc12
InChI key: VEDWXCWBMDQNCV-UHFFFAOYSA-N
