1.0 2010-04-08 22:10:51 UTC 2025-11-19 00:29:43 UTC FDB013691 Melleolide L Metabolite of Armillariella mellea (honey mushroom). Melleolide L is found in mushrooms. 6'-Chloro-10a-hydroxymelleolide Melleolide L C23H27ClO7 450.909 450.144530925 3-formyl-2a,7-dihydroxy-6,6,7b-trimethyl-1H,2H,2aH,4aH,5H,6H,7H,7aH,7bH-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoate 3-formyl-2a,7-dihydroxy-6,6,7b-trimethyl-1H,2H,4aH,5H,7H,7aH-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoate 298702-67-7 CC1=C(C(=O)OC2CC3(C)C4C(CC(C)(C)C4O)C=C(C=O)C23O)C(O)=CC(O)=C1Cl InChI=1S/C23H27ClO7/c1-10-16(13(26)6-14(27)18(10)24)20(29)31-15-8-22(4)17-11(7-21(2,3)19(17)28)5-12(9-25)23(15,22)30/h5-6,9,11,15,17,19,26-28,30H,7-8H2,1-4H3 QXPGYRDUXBYJHG-UHFFFAOYSA-N belongs to the class of organic compounds known as melleolides and analogues. Melleolides and analogues are compounds with a structure characterized by the presence of a 2-hydroxy-4-methoxy-6-methylbenzoic acid derivative linked to a 3,6,6,7b-tetramethyl-cyclobuta[e]indene moiety. Melleolides and analogues Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aromatic homopolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 3-halobenzoic acids and derivatives Aldehydes Aryl chlorides Benzoyl derivatives Carboxylic acid esters Chlorobenzenes Cyclic alcohols and derivatives Hydrocarbon derivatives Meta cresols Monocarboxylic acids and derivatives O-chlorophenols Organic oxides Organochlorides P-chlorophenols Resorcinols Salicylic acid and derivatives Secondary alcohols Tertiary alcohols Toluenes Vinylogous acids o-Hydroxybenzoic acid esters p-Hydroxybenzoic acid alkyl esters 1-hydroxy-2-unsubstituted benzenoid 2-chlorophenol 2-halophenol 3-halobenzoic acid or derivatives 4-chlorophenol 4-halophenol Alcohol Aldehyde Aromatic homopolycyclic compound Aryl chloride Aryl halide Benzenoid Benzoate ester Benzoic acid or derivatives Benzoyl Carbonyl group Carboxylic acid derivative Carboxylic acid ester Chlorobenzene Cyclic alcohol Cyclobutanol Dihydroxybenzoic acid Halobenzene Halobenzoic acid or derivatives Hydrocarbon derivative M-cresol Melleolide-skeleton Monocarboxylic acid or derivatives Monocyclic benzene moiety O-hydroxybenzoic acid ester Organic oxide Organic oxygen compound Organochloride Organohalogen compound Organooxygen compound P-hydroxybenzoic acid alkyl ester P-hydroxybenzoic acid ester Phenol Resorcinol Salicylic acid or derivatives Secondary alcohol Tertiary alcohol Toluene Vinylogous acid logp 2.80 ALOGPS logs -3.83 ALOGPS solubility 6.66e-02 g/l ALOGPS melting_point Mp 123-125° (94-95°) logp 3.56 ChemAxon pka_strongest_acidic 7.21 ChemAxon pka_strongest_basic -3 ChemAxon iupac 3-formyl-2a,7-dihydroxy-6,6,7b-trimethyl-1H,2H,2aH,4aH,5H,6H,7H,7aH,7bH-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoate ChemAxon average_mass 450.909 ChemAxon mono_mass 450.144530925 ChemAxon smiles CC1=C(C(=O)OC2CC3(C)C4C(CC(C)(C)C4O)C=C(C=O)C23O)C(O)=CC(O)=C1Cl ChemAxon formula C23H27ClO7 ChemAxon inchi InChI=1S/C23H27ClO7/c1-10-16(13(26)6-14(27)18(10)24)20(29)31-15-8-22(4)17-11(7-21(2,3)19(17)28)5-12(9-25)23(15,22)30/h5-6,9,11,15,17,19,26-28,30H,7-8H2,1-4H3 ChemAxon inchikey QXPGYRDUXBYJHG-UHFFFAOYSA-N ChemAxon polar_surface_area 124.29 ChemAxon refractivity 114.29 ChemAxon polarizability 45.65 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23834 Specdb::CMs 44171 Specdb::CMs 137767 Specdb::CMs 145501 Specdb::MsMs 96447 Specdb::MsMs 96448 Specdb::MsMs 96449 Specdb::MsMs 160929 Specdb::MsMs 160930 Specdb::MsMs 160931 Specdb::MsMs 2380410 Specdb::MsMs 2380411 Specdb::MsMs 2380412 Specdb::MsMs 2557842 Specdb::MsMs 2557843 Specdb::MsMs 2557844 HMDB35067 #<Reference:0x000055ce31670160> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322