1.0 2010-04-08 22:15:00 UTC 2019-11-26 03:18:53 UTC FDB020402 (9R,10S,12Z)-9,10-Dihydroxy-8-oxo-12-octadecenoic acid Constituent of the edible lions mane mushroom (Hericium erinaceum). (9R,10S,12Z)-9,10-Dihydroxy-8-oxo-12-octadecenoic acid is found in mushrooms. C18H32O5 328.4437 328.224974134 (12E)-9,10-dihydroxy-8-oxooctadec-12-enoic acid (12E)-9,10-dihydroxy-8-oxooctadec-12-enoic acid 142036-13-3 CCCCC\C=C\CC(O)C(O)C(=O)CCCCCCC(O)=O InChI=1S/C18H32O5/c1-2-3-4-5-6-9-12-15(19)18(23)16(20)13-10-7-8-11-14-17(21)22/h6,9,15,18-19,23H,2-5,7-8,10-14H2,1H3,(H,21,22)/b9-6+ NIOKCFABUMZUDL-RMKNXTFCSA-N belongs to the class of organic compounds known as lineolic acids and derivatives. These are derivatives of lineolic acid. Lineolic acid is a polyunsaturated omega-6 18 carbon long fatty acid, with two CC double bonds at the 9- and 12-positions. Lineolic acids and derivatives Organic compounds Lipids and lipid-like molecules Fatty Acyls Lineolic acids and derivatives Aliphatic acyclic compounds 1,2-diols Acyloins Alpha-hydroxy ketones Beta-hydroxy ketones Carboxylic acids Hydrocarbon derivatives Hydroxy fatty acids Keto fatty acids Long-chain fatty acids Monocarboxylic acids and derivatives Monosaccharides Organic oxides Secondary alcohols Unsaturated fatty acids 1,2-diol Acyloin Alcohol Aliphatic acyclic compound Alpha-hydroxy ketone Beta-hydroxy ketone Carbonyl group Carboxylic acid Carboxylic acid derivative Fatty acid Hydrocarbon derivative Hydroxy fatty acid Keto fatty acid Ketone Long-chain fatty acid Monocarboxylic acid or derivatives Monosaccharide Octadecanoid Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Unsaturated fatty acid logp 3.18 ALOGPS logs -3.52 ALOGPS solubility 1.00e-01 g/l ALOGPS melting_point Mp 56-57° logp 3.66 ChemAxon pka_strongest_acidic 4.28 ChemAxon pka_strongest_basic -3.2 ChemAxon iupac (12E)-9,10-dihydroxy-8-oxooctadec-12-enoic acid ChemAxon average_mass 328.4437 ChemAxon mono_mass 328.224974134 ChemAxon smiles CCCCC\C=C\CC(O)C(O)C(=O)CCCCCCC(O)=O ChemAxon formula C18H32O5 ChemAxon inchi InChI=1S/C18H32O5/c1-2-3-4-5-6-9-12-15(19)18(23)16(20)13-10-7-8-11-14-17(21)22/h6,9,15,18-19,23H,2-5,7-8,10-14H2,1H3,(H,21,22)/b9-6+ ChemAxon inchikey NIOKCFABUMZUDL-RMKNXTFCSA-N ChemAxon polar_surface_area 94.83 ChemAxon refractivity 90.9 ChemAxon polarizability 38.54 ChemAxon rotatable_bond_count 15 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11903 Specdb::CMs 46861 Specdb::CMs 137480 Specdb::CMs 145214 Specdb::MsMs 292228 Specdb::MsMs 292229 Specdb::MsMs 292230 Specdb::MsMs 332365 Specdb::MsMs 332366 Specdb::MsMs 332367 Specdb::MsMs 2791100 Specdb::MsMs 2791101 Specdb::MsMs 2791102 Specdb::MsMs 2914466 Specdb::MsMs 2914467 Specdb::MsMs 2914468 HMDB40611 #<Reference:0x000055ce32fced78> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322