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[5-[2-(butanoylamino)-6-oxidanylidene-4,5-dihydro-1H-purin-9-yl]-2-oxidanidyl-2-oxidanylidene-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] butanoate

[5-[2-(butanoylamino)-6-oxidanylidene-4,5-dihydro-1H-purin-9-yl]-2-oxidanidyl-2-oxidanylidene-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] butanoate

Systemtic Name:[5-[2-(butanoylamino)-6-oxidanylidene-4,5-dihydro-1H-purin-9-yl]-2-oxidanidyl-2-oxidanylidene-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] butanoate
Openeye Name:[5-[2-(butanoylamino)-6-oxo-4,5-dihydro-1H-purin-9-yl]-2-oxido-2-oxo-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] butanoate
CAS Name:butanoic acid [2-oxido-2-oxo-5-[6-oxo-2-(1-oxobutylamino)-4,5-dihydro-1H-purin-9-yl]-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] ester
IUPAC Name:[5-[2-(butanoylamino)-6-oxo-4,5-dihydro-1H-purin-9-yl]-2-oxido-2-oxo-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] butanoate
Traditional Name:butyric acid [5-(2-butyramido-6-keto-4,5-dihydro-1H-purin-9-yl)-2-keto-2-oxido-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] ester
Formula: C17H23N5O9P-
MolecularWeight: 472.366381
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2C(C(=O)N1)N=CN2C3C(C4C(O3)OP(=O)(O4)[O-])OC(=O)CCC


Isomeric SMILES

CCCC(=O)NC1=NC2C(C(=O)N1)N=CN2C3C(C4C(O3)OP(=O)(O4)[O-])OC(=O)CCC


InChI

InChI=1S/C17H24N5O9P/c1-3-5-8(23)19-17-20-13-10(14(25)21-17)18-7-22(13)15-11(28-9(24)6-4-2)12-16(29-15)31-32(26,27)30-12/h7,10-13,15-16H,3-6H2,1-2H3,(H,26,27)(H2,19,20,21,23,25)/p-1


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Name: [5-[2-(butanoylamino)-6-oxidanylidene-4,5-dihydro-1H-purin-9-yl]-2-oxidanidyl-2-oxidanylidene-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-6-yl] butanoate

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