[(2R,5R)-5-(6-aminopurin-9-yl)-3-sulfanyl-oxolan-2-yl]methanol; phosphoric acid

Systemtic Name: [(2R,5R)-5-(6-aminopurin-9-yl)-3-sulfanyl-oxolan-2-yl]methanol; phosphoric acid Openeye Name: [(2R,5R)-5-(6-aminopurin-9-yl)-3-sulfanyl-tetrahydrofuran-2-yl]methanol; phosphoric acid CAS Name: [(2R,5R)-5-(6-aminopurin-9-yl)-3-mercapto-2-oxolanyl]methanol; phosphoric acid IUPAC Name: [(2R,5R)-5-(6-aminopurin-9-yl)-3-sulfanyloxolan-2-yl]methanol; phosphoric acid Traditional Name: [(2R,5R)-5-adenin-9-yl-3-mercapto-tetrahydrofuran-2-yl]methanol; phosphoric acid Formula: C10H22N5O14P3S MolecularWeight: 561.293063

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)S.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

Isomeric SMILES

C1[C@@H](O[C@@H](C1S)CO)N2C=NC3=C2N=CN=C3N.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C10H13N5O2S.3H3O4P/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-6(18)5(2-16)17-7;3*1-5(2,3)4/h3-7,16,18H,1-2H2,(H2,11,12,13);3*(H3,1,2,3,4)/t5-,6?,7-;;;/m1.../s1