2.0 2015-09-08 20:07:30 -0600 2015-12-09 12:15:36 -0700 ECMDB24750 M2MDB006867 DG(10:0/17:0cycw7c/0:0) DG(10:0/17:0cycw7c/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(10:0/17:0cycw7c/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway. C30H56O5 496.773 496.412774903 (2S)-3-{[8-(2-hexylcyclopropyl)octanoyl]oxy}-2-hydroxypropyl decanoate (2S)-3-{[8-(2-hexylcyclopropyl)octanoyl]oxy}-2-hydroxypropyl decanoate [H][C@](O)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCC1CC1CCCCCC InChI=1S/C30H56O5/c1-3-5-7-9-10-13-17-21-29(32)34-24-28(31)25-35-30(33)22-18-14-11-12-16-20-27-23-26(27)19-15-8-6-4-2/h26-28,31H,3-25H2,1-2H3/t26?,27?,28-/m0/s1 DMUTVRSDWVEDAC-LADMEODRSA-N logp 8.74 ALOGPS logs -7.12 ALOGPS solubility 3.74e-05 g/l ALOGPS logp 9 ChemAxon pka_strongest_acidic 13.63 ChemAxon pka_strongest_basic -3.4 ChemAxon iupac (2S)-3-{[8-(2-hexylcyclopropyl)octanoyl]oxy}-2-hydroxypropyl decanoate ChemAxon average_mass 496.773 ChemAxon mono_mass 496.412774903 ChemAxon smiles [H][C@](O)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCC1CC1CCCCCC ChemAxon formula C30H56O5 ChemAxon inchi InChI=1S/C30H56O5/c1-3-5-7-9-10-13-17-21-29(32)34-24-28(31)25-35-30(33)22-18-14-11-12-16-20-27-23-26(27)19-15-8-6-4-2/h26-28,31H,3-25H2,1-2H3/t26?,27?,28-/m0/s1 ChemAxon inchikey DMUTVRSDWVEDAC-LADMEODRSA-N ChemAxon polar_surface_area 72.83 ChemAxon refractivity 142.79 ChemAxon polarizability 63.39 ChemAxon rotatable_bond_count 27 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon phospholipid biosynthesis (CL(10:0/17:0cycw7c/14:0/14:0)) Phospholipids are membrane components in E. coli. The major phospholipids of E. coli are phosphatidylethanolamine, phosphatidylglycerol and cardiolipin. All phospholipids contain sn-glycerol-3-phosphate esterified with fatty acids at the sn-1 and sn-2 positions. The reaction starts from a glycerone phosphate (dihydroxyacetone phosphate) produced in glycolysis. The glycerone phosphate is transformed to a sn-glycerol 3-phosphate (glycerol 3 phosphate) by NADPH driven glycerol-3-phosphate dehydrogenase. Sn-glycerol 3-phosphate is transformed to a 1-acyl-sn-glycerol 3-phosphate(1-oleyl-2-lyso-phosphatidate , 1-palmitoylglycerol 3-phosphate , 1-stearoyl-sn-glycerol 3-phosphate). This can be achieve by a sn-glycerol-3-phosphate 1-0-acyltransferase that interacts either with a long-chain acyl-CoA or with an acyl-[acp]. The 1-acyl-sn-glycerol 3-phosphate is transformed into a 1,2-diacyl-sn-glycerol 3-phosphate through a 1-acylglycerol-3-phosphate O-acyltransferase. This compound is then converted into a CPD-diacylglycerol through a CTP (phosphatidate cytididyltransferase. CPD-diacylglycerol can be transformed either to a L-1-phosphatidylserine or a L-1-phosphatidylglycerol-phosphate through a phosphatidylserine synthase or a phosphatidylglycerophosphate synthase respectively. The L-1-phosphatidylserine transforms into L-1-phosphatidylethanolamine through a phosphatidylserine decarboxylase, o the other hand L-1-phosphatidylglycerol-phosphate gets transformed into a L-1-phosphatidyl-glycerol through a phosphatidylglycerophosphatase. These 2 products combines produce a cardiolipin and a ethanolamine. The L-1 phosphatidyl-glycerol can also interact with cardiolipin synthase resulting in a glycerol and a cardiolipin. PW001912 Metabolic Specdb::CMs 1089068 Specdb::EiMs 2844 Specdb::NmrOneD 291815 Specdb::NmrOneD 291816 Specdb::NmrOneD 291817 Specdb::NmrOneD 291818 Specdb::NmrOneD 291819 Specdb::NmrOneD 291820 Specdb::NmrOneD 291821 Specdb::NmrOneD 291822 Specdb::NmrOneD 291823 Specdb::NmrOneD 291824 Specdb::NmrOneD 291825 Specdb::NmrOneD 291826 Specdb::NmrOneD 291827 Specdb::NmrOneD 291828 Specdb::NmrOneD 291829 Specdb::NmrOneD 291830 Specdb::NmrOneD 291831 Specdb::NmrOneD 291832 Specdb::NmrOneD 291833 Specdb::NmrOneD 291834 Specdb::MsMs 3630390 Specdb::MsMs 3630391 Specdb::MsMs 3630392 Specdb::MsMs 3630393 Specdb::MsMs 3630394 Specdb::MsMs 3630395 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 Phosphatidate cytidylyltransferase P0ABG1 CDSA_ECOLI cdsA http://ecmdb.ca/proteins/P0ABG1.xml DG(10:0/17:0cycw7c/0:0) + Cytidine triphosphate + Hydrogen ion > CDP-DG(10:0/17:0cycw7c) + Pyrophosphate PW_R005331