NADPH

NADPH bmse000055 - Data bmst000114 - Theory

NADPH synonyms

2646-71-1; Adenosine 5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'-5'-ester with 1,4-dihydro-1-beta-D-ribofuranosyl-3-pyridinecarboxamide; Dihydronicotinamide-adenine dinucleotide phosphate; Nicotinamide adenine dinucleotide phosphate; TPNH

Wikipedia:

Graphical representations:

NADPH

View large 3D structure

Molecular Formula: C21H30N7O17P3

Natural Isotopic Abundance Mass: 745.4208830000

Mono-Isotopic Molecular Masses:

  • C12N14: 745.091102105
  • C13N14: 766.161553699
  • C12N15: 752.070346357
  • C13N15: 766.161553699

InChI string: InChI=1/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/h1,3-4,7-8,10-11,13-16,20-21,29-31H,2,5-6H2,(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/f/h33-34,36,38H,22-23H2

IUPAC: [(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-5-[[[[(2R,3R,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxymethyl]-4-hydroxy-oxolan-3-yl]oxyphosphonic acid

PubChem Compound (CID): 5884
KEGG Compound ID: C00005
CAS Registry number: 22046-90-8 3545-01-5 53-57-6
ChEBI: 16474
EINECS: 200-177-6

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)