1.0 2010-04-08 22:10:48 UTC 2025-11-18 23:55:26 UTC FDB013590 Gibberellin A61 Constituent of Triticum aestivum (wheat). Gibberellin A61 is found in many foods, some of which are cereals and cereal products, peach, apple, and loquat. GA61 C19H24O5 332.3909 332.162373878 14-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylic acid 14-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylic acid 81826-98-4 CC12CCC(O)C3(OC1=O)C1CCC4CC1(CC4=C)C(C23)C(O)=O InChI=1S/C19H24O5/c1-9-7-18-8-10(9)3-4-11(18)19-12(20)5-6-17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22) JKQCGVABHHQYKQ-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 Oxepanes Secondary alcohols Tetrahydrofurans 20-norgibberellane-6-carboxylic acid Alcohol Aliphatic heteropolycyclic compound Caprolactone 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 Oxepane Secondary alcohol Tetrahydrofuran logp 1.34 ALOGPS logs -2.36 ALOGPS solubility 1.45e+00 g/l ALOGPS melting_point Mp 257-259° logp 1.72 ChemAxon pka_strongest_acidic 4.29 ChemAxon pka_strongest_basic -3.3 ChemAxon iupac 14-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylic acid ChemAxon average_mass 332.3909 ChemAxon mono_mass 332.162373878 ChemAxon smiles CC12CCC(O)C3(OC1=O)C1CCC4CC1(CC4=C)C(C23)C(O)=O ChemAxon formula C19H24O5 ChemAxon inchi InChI=1S/C19H24O5/c1-9-7-18-8-10(9)3-4-11(18)19-12(20)5-6-17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22) ChemAxon inchikey JKQCGVABHHQYKQ-UHFFFAOYSA-N ChemAxon polar_surface_area 83.83 ChemAxon refractivity 83.92 ChemAxon polarizability 34.62 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21903 Specdb::CMs 44125 Specdb::MsMs 77658 Specdb::MsMs 77659 Specdb::MsMs 77660 Specdb::MsMs 137835 Specdb::MsMs 137836 Specdb::MsMs 137837 HMDB0034987 Apple Type 1 specific Malus pumila 283210 Breakfast cereal Type 2 specific Cereals and cereal products Unknown generic Common wheat Type 1 specific Triticum aestivum 4565 Loquat Type 1 specific Eriobotrya japonica 32224 Peach Type 1 specific Prunus persica 3760 Wheat Type 1 specific Triticum 4564