2-[[9-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]-2-methylsulfanyl-purin-6-yl]carbamoylamino]-3-hydroxy-butanoic acid

Molecular Formula: C16H23N6O11PS


InChI: InChI=1/C16H23N6O11PS/c1-5(23)7(14(26)27)18-15(28)19-11-8-12(21-16(20-11)35-2)22(4-17-8)13-10(25)9(24)6(33-13)3-32-34(29,30)31/h4-7,9-10,13,23-25H,3H2,1-2H3,(H,26,27)(H2,29,30,31)(H2,18,19,20,21,28)/f/h18-19,26,29-30H

InChIKey: InChIKey=CVAJCPGRFVTHBT-BMXZKGMHCH
SMILES: CC(C(C(=O)O)NC(=O)NC1=NC(=NC2=C1N=CN2C3C(C(C(O3)COP(=O)(O)O)O)O)SC)O

Names:
    2-[[9-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]-2-methylsulfanyl-purin-6-yl]carbamoylamino]-3-hydroxy-butanoic acid

Registries:
    PubChem CID 4468926
    PubChem ID 6588769