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CHEBI:90170 - 2-hydro-β-NADP

ChEBI IDCHEBI:90170
ChEBI Name2-hydro-β-NADP
Stars
ASCII Name2-hydro-beta-NADP
DefinitionAn NADP obtained by formal reduction of the 1,2-position in the pyridine ring of β-NADP.
Last Modified2 November 2015
SubmitterSteve
DownloadsMolfile
FormulaC21H30N7O17P3
Net Charge0
Average Mass745.425
Monoisotopic Mass745.09110
SMILESNC(=O)C1=CC=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C1
InChIInChI=1S/C21H30N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-3,7-8,10-11,13-16,20-21,29-31H,4-6H2,(H2,23,32)(H,36,37)(H,38,39)(H2,22,24,25)(H2,33,34,35)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
InChIKeySNZSFAQYVLPEBZ-NNYOXOHSSA-N
Roles Classification
Biological Role:
coenzyme  A low-molecular-weight, non-protein organic compound participating in enzymatic reactions as dissociable acceptor or donor of chemical groups or electrons.
ChEBI Ontology
Outgoing Relation(s)
2-hydro-β-NADP (CHEBI:90170) is a NAD(P)H (CHEBI:13392)
2-hydro-β-NADP (CHEBI:90170) is a NADP (CHEBI:25523)
2-hydro-β-NADP (CHEBI:90170) is conjugate acid of 2-hydro-β-NADP(4−) (CHEBI:88137)
Incoming Relation(s)
2-hydro-β-NADP(4−) (CHEBI:88137) is conjugate base of 2-hydro-β-NADP (CHEBI:90170)
IUPAC Name 
2'-O-phosphonoadenosine 5'-{3-[1-(3-carbamoyl-1,2-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}
Citations