HIT ID: HIT212658693
Cas No: 96760-69-9
分子式: C28H32N8O6
分子量: 576.614
常用名: Adenosine amine congener
氢键受体数 (HBA): 11
氢键供体数 (HBD): 7
LogP: -0.49256402
IUPAC: N-(2-aminoethyl)-2-(4-{2-[4-({9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-yl}amino)phenyl]acetamido}phenyl)acetamide
IUPAC: N-(2-aminoethyl)-2-(4-{2-[4-({9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-yl}amino)phenyl]acetamido}phenyl)acetamide
SMILES: NCCNC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4n(cnc34)C3OC(CO)C(O)C3O)cc2)cc1
SMILES: NCCNC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4n(cnc34)C3OC(CO)C(O)C3O)cc2)cc1
InChI key: JFRJCQJVFMHZOO-UHFFFAOYSA-N
