NAADP

Ligand id: 2450

Name: NAADP

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 23
Hydrogen bond donors 9
Rotatable bonds 13
Topological polar surface area 388.43
Molecular weight 745.07
XLogP -6.39
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
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
Synonyms
NAADP+ | nicotinic acid adenine dinucleotide phosphate
Database Links
CAS Registry No. 5502-96-5 (source: Scifinder)
ChEBI CHEBI:76072
PubChem CID 123953
Search Google for chemical match using the InChIKey QOTXBMGJKFVZRD-HISDBWNOSA-O
Search Google for chemicals with the same backbone QOTXBMGJKFVZRD
Search UniChem for chemical match using the InChIKey QOTXBMGJKFVZRD-HISDBWNOSA-O
Search UniChem for chemicals with the same backbone QOTXBMGJKFVZRD
Wikipedia Nicotinic_acid_adenine_dinucleotide_phosphate