Name: AB-MECA
Rating: 5 (10 reviews)

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HIT ID:HIT212667229
Cas No:152918-26-8
常用名:AB-MECA
IUPAC:(2S,3S,4R,5R)-5-(6-{[(4-aminophenyl)methyl]amino}-9H-purin-9-yl)-3,4-dihydroxy-N-methyloxolane-2-carboxamide
IUPAC:(2S,3S,4R,5R)-5-(6-{[(4-aminophenyl)methyl]amino}-9H-purin-9-yl)-3,4-dihydroxy-N-methyloxolane-2-carboxamide
InChI key:LDYMCRRFCMRFKB-MOROJQBDSA-N

分子式:C18H21N7O4
分子量:399.411
氢键供体数 (HBD):5
氢键受体数 (HBA):9
LogP:-1.1567047
SMILES:CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccc(N)cc3)ncnc12
SMILES:CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccc(N)cc3)ncnc12

AB-MECA is a high affinity A3 adenosine receptor agonist. It has high affinity for recombinant A1 and A3 receptors.

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