PDLA5P – Pyridoxamine 5'-phosphate

Name
WID PDLA5P View in model
Name Pyridoxamine 5'-phosphate View in model
Traditional name [4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methyl hydrogen phosphate
IUPAC name [4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methyl hydrogen phosphate
Cross references ChEBI: 18335, PubChem: 3919, CAS: 529-96-4, ThreeDMET: B00154, KNApSAcK: C00007506, ... 3 more
 
Structure
Empirical formula (pH 7.5) H12C8N2O5P1
SMILES (pH 7.5) CC1=NC=C(COP(O)([O-])=O)C(CN)=C1O
Charge (pH 7.5) -1
Is hydrophobic False View in model
Molecular weight (Da) 247.16 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
200.07
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) -560.20
pI 5.19
logP -3.09
logD (pH 7.5) -3.19
 
Function
Reaction participant View in model
 
Metadata
Created 2012-10-01 15:07:05
Last updated 2012-10-01 15:12:27