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2-(6-aminopurin-9-yl)ethoxymethyl-[oxidanyl(phosphonooxy)phosphoryl]oxy-phosphinic acid

2-(6-aminopurin-9-yl)ethoxymethyl-[oxidanyl(phosphonooxy)phosphoryl]oxy-phosphinic acid

Systemtic Name:2-(6-aminopurin-9-yl)ethoxymethyl-[oxidanyl(phosphonooxy)phosphoryl]oxy-phosphinic acid
Openeye Name:2-(6-aminopurin-9-yl)ethoxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphinic acid
CAS Name:2-(6-aminopurin-9-yl)ethoxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid
IUPAC Name:2-(6-aminopurin-9-yl)ethoxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid
Traditional Name:2-adenin-9-ylethoxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphinic acid
Formula: C8H14N5O10P3
MolecularWeight: 433.145543
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OP(=O)(O)OP(=O)(O)O


Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OP(=O)(O)OP(=O)(O)O


InChI

InChI=1S/C8H14N5O10P3/c9-7-6-8(11-3-10-7)13(4-12-6)1-2-21-5-24(14,15)22-26(19,20)23-25(16,17)18/h3-4H,1-2,5H2,(H,14,15)(H,19,20)(H2,9,10,11)(H2,16,17,18)


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