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CHEBI:44336 - NICOTINAMIDE-(6-DEAMINO-6-HYDROXY-ADENINE)-DINUCLEOTIDE PHOSPHATE

Default Structure
ChEBI IDCHEBI:44336
ChEBI NameNICOTINAMIDE-(6-DEAMINO-6-HYDROXY-ADENINE)-DINUCLEOTIDE PHOSPHATE
Stars
DownloadsMolfile
FormulaC21H27N6O18P3
Net Charge0
Average Mass744.393
Monoisotopic Mass744.05947
SMILES[H]Oc1nc([H])nc2c1nc([H])n2[C@]1([H])O[C@]([H])(C([H])([H])O[P@](=O)(O[H])O[P@](=O)([O-])OC([H])([H])[C@@]2([H])O[C@@]([H])([n+]3c([H])c([H])c([H])c(C(=O)N([H])[H])c3[H])[C@]([H])(O[H])[C@]2([H])O[H])[C@@]([H])(O[H])[C@@]1([H])OP(=O)(O[H])O[H]
InChIInChI=1S/C21H27N6O18P3/c22-17(31)9-2-1-3-26(4-9)20-15(30)13(28)10(42-20)5-40-47(36,37)45-48(38,39)41-6-11-14(29)16(44-46(33,34)35)21(43-11)27-8-25-12-18(27)23-7-24-19(12)32/h1-4,7-8,10-11,13-16,20-21,28-30H,5-6H2,(H6-,22,23,24,31,32,33,34,35,36,37,38,39)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
InChIKeyWKSUSMNNBQFESD-NNYOXOHSSA-N
ChEBI Ontology
Outgoing Relation(s)
NICOTINAMIDE-(6-DEAMINO-6-HYDROXY-ADENINE)-DINUCLEOTIDE PHOSPHATE (CHEBI:44336) is a unclassifieds (CHEBI:27189)
Synonym  Source
NICOTINAMIDE-(6-DEAMINO-6-HYDROXY-ADENINE)-DINUCLEOTIDE PHOSPHATEPDBeChem
Manual XrefsDatabases
NDOPDBeChem