1.0 2010-04-08 22:08:11 UTC 2018-05-28 22:21:41 UTC FDB008642 28-Methyl-27-nonacosenoic acid Constituent of Piper retrofractum (Javanese long pepper). C30H58O2 450.7803 450.4436811 28-methylnonacos-27-enoic acid 28-methylnonacos-27-enoic acid 194345-53-4 CC(C)=CCCCCCCCCCCCCCCCCCCCCCCCCCC(O)=O InChI=1S/C30H58O2/c1-29(2)27-25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-28-30(31)32/h27H,3-26,28H2,1-2H3,(H,31,32) ZMHHQHCAPNQNJR-UHFFFAOYSA-N belongs to the class of organic compounds known as very long-chain fatty acids. These are fatty acids with an aliphatic tail that contains at least 22 carbon atoms. Very long-chain fatty acids Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Aliphatic acyclic compounds Branched fatty acids Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Unsaturated fatty acids Aliphatic acyclic compound Branched fatty acid Carbonyl group Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Unsaturated fatty acid Very long-chain fatty acid logp 9.88 ALOGPS logs -7.30 ALOGPS solubility 2.26e-05 g/l ALOGPS melting_point Mp 104° logp 11.92 ChemAxon pka_strongest_acidic 4.95 ChemAxon iupac 28-methylnonacos-27-enoic acid ChemAxon average_mass 450.7803 ChemAxon mono_mass 450.4436811 ChemAxon smiles CC(C)=CCCCCCCCCCCCCCCCCCCCCCCCCCC(O)=O ChemAxon formula C30H58O2 ChemAxon inchi InChI=1S/C30H58O2/c1-29(2)27-25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-28-30(31)32/h27H,3-26,28H2,1-2H3,(H,31,32) ChemAxon inchikey ZMHHQHCAPNQNJR-UHFFFAOYSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 142.3 ChemAxon polarizability 63.52 ChemAxon rotatable_bond_count 26 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22593 Specdb::CMs 42683 Specdb::CMs 133736 Specdb::CMs 141470 Specdb::MsMs 92967 Specdb::MsMs 92968 Specdb::MsMs 92969 Specdb::MsMs 156675 Specdb::MsMs 156676 Specdb::MsMs 156677 Specdb::MsMs 2459767 Specdb::MsMs 2459768 Specdb::MsMs 2459769 Specdb::MsMs 2475779 Specdb::MsMs 2475780 Specdb::MsMs 2475781 HMDB31951 #<Reference:0x000055ce31e42348>