2.0
2012-07-30 14:54:40 -0600
2015-06-03 17:20:42 -0600
ECMDB21133
M2MDB001542
1-Tetradecanoyl-sn-glycerol 3-phosphate
1-tetradecanoyl-sn-glycerol 3-phosphate belongs to the class of Fatty Acid Esters. These are carboxylic ester derivatives of a fatty acid. (inferred from compound structure)
1-tetradecanoyl-sn-glycerol 3-phosphate
1-Tetradecanoyl-sn-glycerol 3-phosphoric acid
C17H33O7P
380.4135
380.196389922
2-hydroxy-3-(phosphonatooxy)propyl tetradecanoate
2-hydroxy-3-(phosphonatooxy)propyl tetradecanoate
CCCCCCCCCCCCCC(=O)OCC(O)COP([O-])([O-])=O
InChI=1S/C17H35O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(19)23-14-16(18)15-24-25(20,21)22/h16,18H,2-15H2,1H3,(H2,20,21,22)/p-2
FAZBDRGXCKPVJU-UHFFFAOYSA-L
Cytosol
Membrane
Periplasm
logp
4.15
logs
-3.96
solubility
4.55e-02 g/l
logp
4.07
pka_strongest_acidic
1.51
pka_strongest_basic
-3.4
iupac
2-hydroxy-3-(phosphonatooxy)propyl tetradecanoate
average_mass
380.4135
mono_mass
380.196389922
smiles
CCCCCCCCCCCCCC(=O)OCC(O)COP([O-])([O-])=O
formula
C17H33O7P
inchi
InChI=1S/C17H35O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(19)23-14-16(18)15-24-25(20,21)22/h16,18H,2-15H2,1H3,(H2,20,21,22)/p-2
inchikey
FAZBDRGXCKPVJU-UHFFFAOYSA-L
polar_surface_area
118.95
refractivity
93.53
polarizability
42.08
rotatable_bond_count
18
acceptor_count
5
donor_count
1
physiological_charge
-2
formal_charge
-2
Specdb::NmrOneD
314061
Specdb::NmrOneD
314062
Specdb::NmrOneD
314063
Specdb::NmrOneD
314064
Specdb::NmrOneD
314065
Specdb::NmrOneD
314066
Specdb::NmrOneD
314067
Specdb::NmrOneD
314068
Specdb::NmrOneD
314069
Specdb::NmrOneD
314070
Specdb::NmrOneD
314071
Specdb::NmrOneD
314072
Specdb::NmrOneD
314073
Specdb::NmrOneD
314074
Specdb::NmrOneD
314075
Specdb::NmrOneD
314076
Specdb::NmrOneD
314077
Specdb::NmrOneD
314078
Specdb::NmrOneD
314079
Specdb::NmrOneD
314080
Specdb::MsMs
28739
Specdb::MsMs
28740
Specdb::MsMs
28741
Specdb::MsMs
35297
Specdb::MsMs
35298
Specdb::MsMs
35299
45479329
CPD0-2254
Yurtsever D. (2007). Fatty acid methyl ester profiling of Enterococcus and Esherichia coli for microbial source tracking. M.sc. Thesis. Villanova University: U.S.A
Glycerol-3-phosphate acyltransferase
P0A7A7
PLSB_ECOLI
plsB
http://ecmdb.ca/proteins/P0A7A7.xml
Phospholipase A1
P0A921
PA1_ECOLI
pldA
http://ecmdb.ca/proteins/P0A921.xml
Acyl-CoA thioesterase I
P0ADA1
TESA_ECOLI
tesA
http://ecmdb.ca/proteins/P0ADA1.xml
1-acyl-sn-glycerol-3-phosphate acyltransferase
P26647
PLSC_ECOLI
plsC
http://ecmdb.ca/proteins/P26647.xml
Probable glycerol-3-phosphate acyltransferase
P60782
PLSY_ECOLI
plsY
http://ecmdb.ca/proteins/P60782.xml
Acyl carrier protein
P0A6A8
ACP_ECOLI
acpP
http://ecmdb.ca/proteins/P0A6A8.xml
Glycerol 3-phosphate + Myristoyl-ACP (n-C14:0ACP) > 1-Tetradecanoyl-sn-glycerol 3-phosphate + acyl carrier protein
1-Tetradecanoyl-sn-glycerol 3-phosphate + Water > Glycerol 3-phosphate + Hydrogen ion + tetradecanoate (n-C14:0)
1-Tetradecanoyl-sn-glycerol 3-phosphate + Myristoyl-ACP (n-C14:0ACP) > acyl carrier protein + PA(16:0/16:0)
Glycerol 3-phosphate + Tetradecanoyl-phosphate (n-C14:0) > 1-Tetradecanoyl-sn-glycerol 3-phosphate + Hydrogen ion + Phosphate
Water + PA(16:0/16:0) > 1-Tetradecanoyl-sn-glycerol 3-phosphate + Hydrogen ion + tetradecanoate (n-C14:0)