1.0 2010-04-08 22:15:35 UTC 2019-11-26 03:20:08 UTC FDB021273 Gibberellin A95 Constituent of Prunus cerasus (cherry) seeds. Gibberellin A95 is found in fruits, sour cherry, and peach. GA95 Gibberellin A95 C19H22O5 330.375 330.146723814 5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid 5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid 78259-50-4 CC12CC=CC3(OC1=O)C1CCC4(O)CC1(CC4=C)C(C23)C(O)=O InChI=1S/C19H22O5/c1-10-8-17-9-18(10,23)7-4-11(17)19-6-3-5-16(2,15(22)24-19)13(19)12(17)14(20)21/h3,6,11-13,23H,1,4-5,7-9H2,2H3,(H,20,21) UXLXLQYIDWLPKX-UHFFFAOYSA-N belongs to the class of organic compounds known as c19-gibberellin 6-carboxylic acids. These are c19-gibberellins with a carboxyl group at the 6-position. C19-gibberellin 6-carboxylic acids Organic compounds Lipids and lipid-like molecules Prenol lipids Diterpenoids Aliphatic heteropolycyclic compounds Carbonyl compounds Carboxylic acid esters Carboxylic acids Cyclic alcohols and derivatives Dicarboxylic acids and derivatives Diterpene lactones Gamma butyrolactones Hydrocarbon derivatives Organic oxides Oxacyclic compounds Tertiary alcohols Tetrahydrofurans 20-norgibberellane-6-carboxylic acid Alcohol Aliphatic heteropolycyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Carboxylic acid ester Cyclic alcohol Dicarboxylic acid or derivatives Diterpene lactone Gamma butyrolactone Hydrocarbon derivative Lactone Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Tertiary alcohol Tetrahydrofuran logp 1.54 ALOGPS logs -2.67 ALOGPS solubility 7.09e-01 g/l ALOGPS logp 1.43 ChemAxon pka_strongest_acidic 4.26 ChemAxon pka_strongest_basic -0.9 ChemAxon iupac 5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid ChemAxon average_mass 330.375 ChemAxon mono_mass 330.146723814 ChemAxon smiles CC12CC=CC3(OC1=O)C1CCC4(O)CC1(CC4=C)C(C23)C(O)=O ChemAxon formula C19H22O5 ChemAxon inchi InChI=1S/C19H22O5/c1-10-8-17-9-18(10,23)7-4-11(17)19-6-3-5-16(2,15(22)24-19)13(19)12(17)14(20)21/h3,6,11-13,23H,1,4-5,7-9H2,2H3,(H,20,21) ChemAxon inchikey UXLXLQYIDWLPKX-UHFFFAOYSA-N ChemAxon polar_surface_area 83.83 ChemAxon refractivity 85.05 ChemAxon polarizability 34 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 26081 Specdb::CMs 47269 Specdb::MsMs 323773 Specdb::MsMs 323774 Specdb::MsMs 323775 Specdb::MsMs 372016 Specdb::MsMs 372017 Specdb::MsMs 372018 HMDB41350 #<Reference:0x000055ce31f3ebe8> Fruits Unknown generic Peach Type 1 specific Prunus persica 3760 Sour cherry Type 1 specific Prunus cerasus 140311