[[5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate

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Grundinformationen

Standard-SMILES: NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1
InChIKey: ACFIXJIJDZMPPO-UHFFFAOYSA-N
Summenformel: C21H30N7O17P3
Durchschnittliche Molmasse: 745,4 g/mol
Monoisotopische Masse: 745,09110351

Überblick

Dihydro-nicotinamide-adenine-dinucleotide phosphate has been reported in Homo sapiens with data available.

Namen und Bezeichner

Bevorzugter Name: [[5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
IUPAC: [[5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate

Namen und Synonyme

dihydro-nicotinamide-adenine-dinucleotide phosphate|A-NADPH-d|A-TPNH-dDihydro-codehydrogenase II-dSCHEMBL29362930Triphosphopyridine Nucleotide-d Reduced25 MG-NICOTINAMIDE ADENINE DINUCLEOTIDEPHOSPHATE REDUCED.NA4-SALT AN.GR.[[5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate|A-Nicotinamide-adenine-dinucleotide-phosphoric Acid-dAdenosine 5'-(trihydrogen diphosphate) 2'-(Dihydrogen Phosphate) P'-5'-Ester with (4S)-1,4-Dihydro-1-|A-d-ribofuranosyl-3-pyridine-4-d-carboxamideIminodicarboxylic Acid Di-tert-butyl Ester; Di-t-butyl iminodicarboxylate; [[(2S,3S,4S,5S)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-te trahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2S,3R,4S,5S)-5-( 3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxy-tetra

Datenbank-Bezeichner

PubChem CID: 930

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -6,8
Polarare Oberfläche (TPSA): 364 Å²
H-Brücken-Donoren: 9
H-Brücken-Akzeptoren: 22
Frei drehbare Bindungen: 13
Schwere Atome: 48
Formalladung: 0
Komplexität: 1.410

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HRID 121593als EduktTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 669570als EduktTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 832243als EduktTest data from https://doi.org/10.1039/C8SC04228D

HRID 835499als EduktTest data from https://doi.org/10.1039/C8SC04228D

HRID 1223969als EduktTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1224251als EduktTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1542096als EduktTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

HRID 2158836als EduktTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

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