CHEBI:181958 - [5-(2-Amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methylperoxy phosphono hydrogen phosphate

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ChEBI Name [5-(2-Amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methylperoxy phosphono hydrogen phosphate
ChEBI ID CHEBI:181958
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H15N5O12P2
Net Charge 0
Average Mass 459.201
Monoisotopic Mass 459.01924
InChI InChI=1S/C10H15N5O12P2/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(24-6)2-23-25-26-29(21,22)27-28(18,19)20/h3-6,16H,1-2H2,(H,21,22)(H2,18,19,20)(H3,11,13,14,17)
InChIKey SAPCIEOXJQVQEU-UHFFFAOYSA-N
SMILES P(OOOCC1OC(N2C=3N=C(NC(=O)C3N=C2)N)CC1O)(OP(O)(O)=O)(O)=O
ChEBI Ontology
Outgoing [5-(2-Amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methylperoxy phosphono hydrogen phosphate (CHEBI:181958) is a purine 2'-deoxyribonucleoside (CHEBI:19254)
IUPAC Name
[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methylperoxy phosphono hydrogen phosphate