1.0 2016-09-30 23:01:15 UTC 2020-04-22 15:11:16 UTC BMDB0002685 BMDB02685 Prostaglandin F1a (13E,15S)-9alpha,11alpha-9,11,15-Trihydroxyprost-13-en-1-Oic acid PGF 1-alpha Prostaglandin F1 Prostaglandin F1-alpha (13E,15S)-9a,11a-9,11,15-Trihydroxyprost-13-en-1-Oate (13E,15S)-9a,11a-9,11,15-Trihydroxyprost-13-en-1-Oic acid (13E,15S)-9alpha,11alpha-9,11,15-Trihydroxyprost-13-en-1-Oate (13E,15S)-9Α,11α-9,11,15-trihydroxyprost-13-en-1-Oate (13E,15S)-9Α,11α-9,11,15-trihydroxyprost-13-en-1-Oic acid PGF 1-a PGF 1-Α Prostaglandin F1-a Prostaglandin F1-α 3,5-Dihydroxy-2-(3-hydroxy-1-octenyl)- (8ci)-cyclopentaneheptanoate 3,5-Dihydroxy-2-(3-hydroxy-1-octenyl)- (8ci)-cyclopentaneheptanoic acid 9a,11a,15(S)-Trihydroxy-13-trans-prostenoate 9a,11a,15(S)-Trihydroxy-13-trans-prostenoic acid Prostaglandin F1alpha PGF1 Prostaglandin F1, (9alpha,11beta,13E,15S)-isomer PGF1alpha PGF1 alpha Prostaglandin F1, (9alpha,11alpha,13E,15S)-(+-)-isomer Prostaglandin F1, (8beta,9alpha,11alpha,13E,15S)-isomer Prostaglandin F1, (9alpha,11alpha,13E,15R)-isomer PGF1a PGF1Α C20H36O5 356.4968 356.256274262 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]cyclopentyl]heptanoic acid prostaglandin f1α 745-62-0 CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(O)=O InChI=1S/C20H36O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-19,21-23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+,18-,19+/m0/s1 DZUXGQBLFALXCR-CDIPTNKSSA-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. Organic compounds Lipids and lipid-like molecules Fatty Acyls Eicosanoids Prostaglandins and related compounds Carbonyl compounds Carboxylic acids Cyclic alcohols and derivatives Cyclopentanols Fatty alcohols Hydrocarbon derivatives Hydroxy fatty acids Long-chain fatty acids Monocarboxylic acids and derivatives Organic oxides Alcohol Aliphatic homomonocyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Cyclic alcohol Cyclopentanol Fatty alcohol Hydrocarbon derivative Hydroxy fatty acid Long-chain fatty acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Prostaglandin skeleton Secondary alcohol Aliphatic homomonocyclic compounds Prostaglandins Prostaglandins prostaglandins Falpha Solid logp 3.95 ALOGPS logs -3.50 ALOGPS logp 2.97 ChemAxon pka_strongest_acidic 4.41 ChemAxon pka_strongest_basic -1.6 ChemAxon iupac 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]cyclopentyl]heptanoic acid ChemAxon average_mass 356.4968 ChemAxon mono_mass 356.256274262 ChemAxon smiles CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(O)=O ChemAxon formula C20H36O5 ChemAxon inchi InChI=1S/C20H36O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-19,21-23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+,18-,19+/m0/s1 ChemAxon inchikey DZUXGQBLFALXCR-CDIPTNKSSA-N ChemAxon polar_surface_area 97.99 ChemAxon refractivity 99.35 ChemAxon polarizability 42.53 ChemAxon rotatable_bond_count 13 ChemAxon acceptor_count 5 ChemAxon donor_count 4 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon number_of_rings 1 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::MsMs 293902 Specdb::MsMs 293903 Specdb::MsMs 293904 Specdb::MsMs 334492 Specdb::MsMs 334493 Specdb::MsMs 334494 Specdb::MsMs 2791415 Specdb::MsMs 2791416 Specdb::MsMs 2791417 Specdb::MsMs 2914952 Specdb::MsMs 2914953 Specdb::MsMs 2914954 Specdb::CMs 12702 Specdb::CMs 38459 Specdb::CMs 136957 Specdb::CMs 144691 FDB023044 4444441 C06475 5280939 28852 3503 Schneider, William P.; Murray, Herbert C. Microbiological reduction and resolution of prostaglandins. Synthesis of natural PGF2a and ENT-PGF2b methyl esters. Journal of Organic Chemistry (1973), 38(2), 397-8.