1.0 2011-09-21 01:52:50 UTC 2015-07-21 06:59:40 UTC FDB029264 Prostaglandin G1 Prostaglandin G1 belongs to the family of Prostaglandins Prostaglandins are eicosanoids. The eicosanoids consist of the prostaglandins (PGs), thromboxanes (TXs), leukotrienes (LTs) and lipoxins (LXs). The PGs and TXs are collectively identified as prostanoids. Prostaglandins were originally shown to be synthesized in the prostate gland, thromboxanes from platelets (thrombocytes) and leukotrienes from leukocytes, hence the derivation of their names. All mammalian cells except erythrocytes synthesize eicosanoids. These molecules are extremely potent, able to cause profound physiological effects at very dilute concentrations. All eicosanoids function locally at the site of synthesis, through receptor-mediated G-protein linked signaling pathways. [HMDB] (9S)-hydroperoxy-(5Z,7E,11Z,14Z)-eicosatetraenoate (9S)-hydroperoxy-(5Z,7E,11Z,14Z)-eicosatetraenoic acid 9alpha, 11alpha-epidioxy-15(S)-hydroperoxy-13-trans-prostenoate 9alpha, 11alpha-epidioxy-15(S)-hydroperoxy-13-trans-prostenoic acid 9S-HPETE PGG(,1) C20H34O6 370.4804 370.23553882 7-[(1S,4R,5S,6S)-6-[(1E,3S)-3-hydroperoxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl]heptanoic acid 7-[(1S,4R,5S,6S)-6-[(1E,3S)-3-hydroperoxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl]heptanoic acid CCCCC[C@H](OO)\C=C\[C@@H]1[C@@H]2C[C@@H](OO2)[C@H]1CCCCCCC(O)=O InChI=1S/C20H34O6/c1-2-3-6-9-15(24-23)12-13-17-16(18-14-19(17)26-25-18)10-7-4-5-8-11-20(21)22/h12-13,15-19,23H,2-11,14H2,1H3,(H,21,22)/b13-12+/t15-,16-,17-,18+,19-/m0/s1 QXCRWNZYEVOQMB-NDWDMBLISA-N belongs to the class of organic compounds known as prostaglandins and related compounds. These are unsaturated carboxylic acids consisting of a 20 carbon skeleton that also contains a five member ring, and are based upon the fatty acid arachidonic acid. Prostaglandins and related compounds Organic compounds Lipids and lipid-like molecules Fatty Acyls Eicosanoids Aliphatic heteropolycyclic compounds 1,2-dioxanes 1,2-dioxolanes Alkyl hydroperoxides Allylic hydroperoxides Carbonyl compounds Carboxylic acids Dialkyl peroxides Heterocyclic fatty acids Hydrocarbon derivatives Hydroperoxy fatty acids Long-chain fatty acids Monocarboxylic acids and derivatives Oxacyclic compounds Peroxols Aliphatic heteropolycyclic compound Alkyl hydroperoxide Allylic hydroperoxide Carbonyl group Carboxylic acid Carboxylic acid derivative Dialkyl peroxide Heterocyclic fatty acid Hydrocarbon derivative Hydroperoxide Hydroperoxy fatty acid Long-chain fatty acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Ortho-dioxane Ortho-dioxolane Oxacycle Peroxol Prostaglandin skeleton Solid logp 4.32 ALOGPS logs -4.41 ALOGPS solubility 1.45e-02 g/l ALOGPS logp 4.77 ChemAxon pka_strongest_acidic 4.41 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac 7-[(1S,4R,5S,6S)-6-[(1E,3S)-3-hydroperoxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl]heptanoic acid ChemAxon average_mass 370.4804 ChemAxon mono_mass 370.23553882 ChemAxon smiles CCCCC[C@H](OO)\C=C\[C@@H]1[C@@H]2C[C@@H](OO2)[C@H]1CCCCCCC(O)=O ChemAxon formula C20H34O6 ChemAxon inchi InChI=1S/C20H34O6/c1-2-3-6-9-15(24-23)12-13-17-16(18-14-19(17)26-25-18)10-7-4-5-8-11-20(21)22/h12-13,15-19,23H,2-11,14H2,1H3,(H,21,22)/b13-12+/t15-,16-,17-,18+,19-/m0/s1 ChemAxon inchikey QXCRWNZYEVOQMB-NDWDMBLISA-N ChemAxon polar_surface_area 85.22 ChemAxon refractivity 98.28 ChemAxon polarizability 42.05 ChemAxon rotatable_bond_count 14 ChemAxon acceptor_count 6 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15720 Specdb::CMs 40042 Specdb::CMs 151856 Specdb::MsMs 300844 Specdb::MsMs 300845 Specdb::MsMs 300846 Specdb::MsMs 343216 Specdb::MsMs 343217 Specdb::MsMs 343218 Specdb::MsMs 2438305 Specdb::MsMs 2438306 Specdb::MsMs 2438307 Specdb::MsMs 2528247 Specdb::MsMs 2528248 Specdb::MsMs 2528249 HMDB13039