[(3aS,4R,9S,10aS)-4-(aminocarbonyloxymethyl)-2,6-bis(azanyl)-10,10-bis(oxidanyl)-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-9-yl] sulfate; hydron

Systemtic Name: [(3aS,4R,9S,10aS)-4-(aminocarbonyloxymethyl)-2,6-bis(azanyl)-10,10-bis(oxidanyl)-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-9-yl] sulfate; hydron Openeye Name: [(3aS,4R,9S,10aS)-2,6-diamino-4-(carbamoyloxymethyl)-10,10-dihydroxy-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-9-yl] sulfate; hydron CAS Name: [(3aS,4R,9S,10aS)-2,6-diamino-4-(carbamoyloxymethyl)-10,10-dihydroxy-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-9-yl] sulfate; hydron IUPAC Name: [(3aS,4R,9S,10aS)-2,6-diamino-4-(carbamoyloxymethyl)-10,10-dihydroxy-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-9-yl] sulfate; hydron Traditional Name: [(3aS,4R,9S,10aS)-2,6-diamino-4-(carbamoyloxymethyl)-10,10-dihydroxy-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-9-yl] sulfate; hydron Formula: C10H17N7O8S MolecularWeight: 395.34908

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Descriptors Computed from Structure

Canonical SMILES:

[H+].C1C(C(C23N1C(=NC(C2NC(=N3)N)COC(=O)N)N)(O)O)OS(=O)(=O)[O-]

Isomeric SMILES

[H+].C1[C@@H](C([C@@]23N1C(=N[C@H]([C@@H]2NC(=N3)N)COC(=O)N)N)(O)O)OS(=O)(=O)[O-]

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)/t3-,4-,5-,9-/m0/s1