Structure via PubChem · Public domain (PubChem)
NAADP
Sign in to saveAlso known as NAADP+, nicotinic acid adenine dinucleotide phosphate, NAADP(1+), nicotinic acid-adenine dinucleotide phosphate(1+)
chemical compound
Chemical data
- Formula
- C21H28N6O18P3+
- Molecular weight
- 745.4 g/mol
- IUPAC name
- 1-[(2R,3R,4S,5R)-5-[[[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]pyridin-1-ium-3-carboxylic acid
- SMILES
- C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O)C(=O)O
- InChIKey
- QOTXBMGJKFVZRD-HISDBWNOSA-O
- XLogP
- -6.4
- Polar surface area
- 359 Ų
- H-bond donors
- 9
- H-bond acceptors
- 22
- Formal charge
- 1
via PubChem
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 745.067293
Show 4 more facts
- chemical formula
- C₂₁H₂₈N₆O₁₈P₃⁺
- canonical SMILES
- C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)OP(=O)(O)O)O)O)O)C(=O)O
- isomeric SMILES
- C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN=C5N)OP(=O)(O)O)O)O)O)C(=O)O
- Commons category
- Nicotinic acid adenine dinucleotide phosphate
Sources (1)
via Wikidata · CC0