DAG181 – Diacylglycerol (n-18:1)

Name
WID DAG181 View in model
Name Diacylglycerol (n-18:1) View in model
Traditional name 1-hydroxy-3-(octadec-11-enoyloxy)propan-2-yl octadec-11-enoate
IUPAC name diradylglycerol
Cross references KEGG: C00641
 
Classification
Type lipid_diacylglycerol View in model
 
Structure
Empirical formula (pH 7.5) H72C39O5
SMILES (pH 7.5) CCCCCCC=CCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCC=CCCCCCC
Charge (pH 7.5) 0
Is hydrophobic True View in model
Molecular weight (Da) 620.98 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
690.84
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) 0.0
pI 5.80
logP 13.06
logD (pH 7.5) 13.06
 
Concentrations
Biomass composition (SP4 media, 
5% CO2, 37C; mmol gDCW‑1)
  • 0.00168558 [m]

View in model
 
Function
Reaction participant View in model
 
Metadata
Created 2012-10-01 15:06:53
Last updated 2012-10-01 15:12:00