1.0 2010-04-08 22:12:48 UTC 2019-11-26 03:14:08 UTC FDB017049 Ganodermic acid TQ Metabolite of Ganoderma lucidum (reishi). Ganodermic acid TQ is found in mushrooms. 15-Acetoxy-3-oxolanosta-7,9(11),24-trien-26-oic acid Ganodermic acid TQ C32H46O5 510.7046 510.334524582 (2E)-6-[12-(acetyloxy)-2,6,6,11,15-pentamethyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),9-dien-14-yl]-2-methylhept-2-enoic acid (2E)-6-[12-(acetyloxy)-2,6,6,11,15-pentamethyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),9-dien-14-yl]-2-methylhept-2-enoic acid 112430-66-7 CC(CC\C=C(/C)C(O)=O)C1CC(OC(C)=O)C2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CCC12C InChI=1S/C32H46O5/c1-19(10-9-11-20(2)28(35)36)24-18-27(37-21(3)33)32(8)23-12-13-25-29(4,5)26(34)15-16-30(25,6)22(23)14-17-31(24,32)7/h11-12,14,19,24-25,27H,9-10,13,15-18H2,1-8H3,(H,35,36)/b20-11+ JVABUELIHJXLKP-RGVLZGJSSA-N belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Triterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Triterpenoids Aliphatic homopolycyclic compounds 3-oxo delta-7-steroids Bile acids, alcohols and derivatives Carboxylic acid esters Carboxylic acids Cyclic ketones Delta-7-steroids Dicarboxylic acids and derivatives Hydrocarbon derivatives Medium-chain fatty acids Organic oxides Steroid acids Steroid esters Unsaturated fatty acids 3-oxo-delta-7-steroid 3-oxosteroid Aliphatic homopolycyclic compound Bile acid, alcohol, or derivatives Carbonyl group Carboxylic acid Carboxylic acid derivative Carboxylic acid ester Cholane-skeleton Cyclic ketone Delta-7-steroid Dicarboxylic acid or derivatives Fatty acid Fatty acyl Hydrocarbon derivative Ketone Medium-chain fatty acid Organic oxide Organic oxygen compound Organooxygen compound Oxosteroid Steroid Steroid acid Steroid ester Triterpenoid Unsaturated fatty acid logp 7.26 ALOGPS logs -5.86 ALOGPS solubility 6.99e-04 g/l ALOGPS logp 6.31 ChemAxon pka_strongest_acidic 4.66 ChemAxon pka_strongest_basic -6.9 ChemAxon iupac (2E)-6-[12-(acetyloxy)-2,6,6,11,15-pentamethyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),9-dien-14-yl]-2-methylhept-2-enoic acid ChemAxon average_mass 510.7046 ChemAxon mono_mass 510.334524582 ChemAxon smiles CC(CC\C=C(/C)C(O)=O)C1CC(OC(C)=O)C2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CCC12C ChemAxon formula C32H46O5 ChemAxon inchi InChI=1S/C32H46O5/c1-19(10-9-11-20(2)28(35)36)24-18-27(37-21(3)33)32(8)23-12-13-25-29(4,5)26(34)15-16-30(25,6)22(23)14-17-31(24,32)7/h11-12,14,19,24-25,27H,9-10,13,15-18H2,1-8H3,(H,35,36)/b20-11+ ChemAxon inchikey JVABUELIHJXLKP-RGVLZGJSSA-N ChemAxon polar_surface_area 80.67 ChemAxon refractivity 147.22 ChemAxon polarizability 59.19 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18866 Specdb::CMs 45581 Specdb::MsMs 97920 Specdb::MsMs 97921 Specdb::MsMs 97922 Specdb::MsMs 162726 Specdb::MsMs 162727 Specdb::MsMs 162728 Specdb::MsMs 2774969 Specdb::MsMs 2774970 Specdb::MsMs 2774971 Specdb::MsMs 2906913 Specdb::MsMs 2906914 Specdb::MsMs 2906915 HMDB37893 #<Reference:0x000055ce319fe200> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322