60508-89-6
AlkaPlorer ID: AK035372
Synonym: None
IUPAC Name: [(3aS,4R,9S,10aS)-2,6-diamino-10,10-dihydroxy-9-sulfooxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-4-yl]methoxymethanimidate
Structure
SMILES: N=C1N[C@H]2[C@H](COC(=N)[O-])NC(=N)N3C[C@H](OS(=O)(=O)O)C(O)(O)[C@]23N1
InChI: InChI=1S/C10H17N7O8S/c11-6-15-5-3(2-24-8(13)18)14-7(12)17-1-4(25-26(21,22)23)10(19,20)9(5,17)16-6/h3-5,19-20H,1-2H2,(H2,12,14)(H2,13,18)(H3,11,15,16)(H,21,22,23)/p-1/t3-,4-,5-,9-/m0/s1
InChIKey: ARSXTTJGWGCRRR-LJRZAWCWSA-M
Source
Properties Information
Molecule Weight: 394.3460000000001
TPSA？: 247.23
MolLogP？: -5.418389999999996
Number of H-Donors: 9
Number of H-Acceptors: 10
RingCount: 3
Activities Information
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