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CHEBI:165807 - dApdA

ChEBI IDCHEBI:165807
ChEBI NamedApdA
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Last Modified12 May 2021
SubmitterMetaboLights
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FormulaC20H25N10O8P
Net Charge0
Average Mass564.456
Monoisotopic Mass564.15944
SMILESNc1ncnc2c1ncn2[C@H]1C[C@H](OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C[C@@H]2O)[C@@H](CO)O1
InChIInChI=1S/C20H25N10O8P/c21-17-15-19(25-5-23-17)29(7-27-15)13-1-9(32)12(37-13)4-35-39(33,34)38-10-2-14(36-11(10)3-31)30-8-28-16-18(22)24-6-26-20(16)30/h5-14,31-32H,1-4H2,(H,33,34)(H2,21,23,25)(H2,22,24,26)/t9-,10-,11+,12+,13+,14+/m0/s1
InChIKeyVYQONXIMMXHHKS-PRSXHHODSA-N
ChEBI Ontology
Outgoing Relation(s)
dApdA (CHEBI:165807) is a nucleoside analogue (CHEBI:60783)
dApdA (CHEBI:165807) is a purines (CHEBI:26401)
IUPAC Name 
(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl [(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxytetrahydrofuran-2-yl]methyl hydrogen phosphate
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