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CHEBI:165809 - dApdG

ChEBI IDCHEBI:165809
ChEBI NamedApdG
Stars
Last Modified12 May 2021
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H25N10O9P
Net Charge0
Average Mass580.455
Monoisotopic Mass580.15436
SMILESNc1nc(=O)c2ncn([C@H]3C[C@H](O)[C@@H](COP(=O)(O)O[C@H]4C[C@H](n5cnc6c(N)ncnc65)O[C@@H]4CO)O3)c2n1
InChIInChI=1S/C20H25N10O9P/c21-16-14-17(24-5-23-16)29(6-25-14)13-2-9(10(3-31)37-13)39-40(34,35)36-4-11-8(32)1-12(38-11)30-7-26-15-18(30)27-20(22)28-19(15)33/h5-13,31-32H,1-4H2,(H,34,35)(H2,21,23,24)(H3,22,27,28,33)/t8-,9-,10+,11+,12+,13+/m0/s1
InChIKeyHCGVHZGSMKEALA-LSUSWQKBSA-N
ChEBI Ontology
Outgoing Relation(s)
dApdG (CHEBI:165809) is a nucleoside analogue (CHEBI:60783)
dApdG (CHEBI:165809) is a purines (CHEBI:26401)
IUPAC Name 
[(2R,3S,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3-hydroxytetrahydrofuran-2-yl]methyl (2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl hydrogen phosphate