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CHEBI:44248 - N6-BENZYL ADENOSINE-5'-DIPHOSPHATE

Default Structure
ChEBI IDCHEBI:44248
ChEBI NameN6-BENZYL ADENOSINE-5'-DIPHOSPHATE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC17H21N5O10P2
Net Charge0
Average Mass517.328
Monoisotopic Mass517.07637
SMILES[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(n2c([H])nc3c(N([H])C([H])([H])c4c([H])c([H])c([H])c([H])c4[H])nc([H])nc32)O[C@]1([H])C([H])([H])O[P@@](=O)(O[H])OP(=O)(O[H])O[H]
InChIInChI=1S/C17H21N5O10P2/c23-13-11(7-30-34(28,29)32-33(25,26)27)31-17(14(13)24)22-9-21-12-15(19-8-20-16(12)22)18-6-10-4-2-1-3-5-10/h1-5,8-9,11,13-14,17,23-24H,6-7H2,(H,28,29)(H,18,19,20)(H2,25,26,27)/t11-,13-,14-,17-/m1/s1
InChIKeyMRHGMAGSDAQUFH-LSCFUAHRSA-N
ChEBI Ontology
Outgoing Relation(s)
N6-BENZYL ADENOSINE-5'-DIPHOSPHATE (CHEBI:44248) is a unclassifieds (CHEBI:27189)
Synonyms  Source
N6-BENZYL ADENOSINE-5'-DIPHOSPHATEPDBeChem
N-benzyladenosine 5'-(trihydrogen diphosphate)PDBeChem
Manual XrefsDatabases
NBSPDBeChem