2-[[4-[[6-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-7-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxymethyl]-7-(carboxymethyloxy)-2-oxidanylidene-3,4-dihydrochromen-6-yl]oxy]ethanoic acid

Systemtic Name: 2-[[4-[[6-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-7-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxymethyl]-7-(carboxymethyloxy)-2-oxidanylidene-3,4-dihydrochromen-6-yl]oxy]ethanoic acid Openeye Name: 2-[4-[[6-(2-amino-6-oxo-3H-purin-9-yl)-7-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxymethyl]-7-(carboxymethyloxy)-2-oxo-chroman-6-yl]oxyacetic acid CAS Name: 2-[[4-[[6-(2-amino-6-oxo-3H-purin-9-yl)-7-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-2-yl]oxymethyl]-7-(carboxymethyloxy)-2-oxo-3,4-dihydro-2H-1-benzopyran-6-yl]oxy]acetic acid IUPAC Name: 2-[[4-[[6-(2-amino-6-oxo-3H-purin-9-yl)-7-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxymethyl]-7-(carboxymethyloxy)-2-oxo-3,4-dihydrochromen-6-yl]oxy]acetic acid Traditional Name: 2-[4-[[6-(2-amino-6-keto-3H-purin-9-yl)-7-hydroxy-2-keto-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-2-yl]oxymethyl]-7-(carboxymethyloxy)-2-keto-chroman-6-yl]oxyacetic acid Formula: C24H24N5O15P MolecularWeight: 653.445621

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC(=C(C=C2OC1=O)OCC(=O)O)OCC(=O)O)COP3(=O)OCC4C(O3)C(C(O4)N5C=NC6=C5NC(=NC6=O)N)O

Isomeric SMILES

C1C(C2=CC(=C(C=C2OC1=O)OCC(=O)O)OCC(=O)O)COP3(=O)OCC4C(O3)C(C(O4)N5C=NC6=C5NC(=NC6=O)N)O

InChI

InChI=1S/C24H24N5O15P/c25-24-27-21-18(22(36)28-24)26-8-29(21)23-19(35)20-14(43-23)5-41-45(37,44-20)40-4-9-1-17(34)42-11-3-13(39-7-16(32)33)12(2-10(9)11)38-6-15(30)31/h2-3,8-9,14,19-20,23,35H,1,4-7H2,(H,30,31)(H,32,33)(H3,25,27,28,36)