1.0 2010-04-08 22:11:31 UTC 2019-11-26 03:10:51 UTC FDB014874 Isomarasmone Constituent of Marasmius oreades (fairy ring mushroom). Isomarasmone is found in mushrooms. Isomarasmone C15H18O5 278.3004 278.115423686 2-hydroxy-5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0¹,⁶.0¹²,¹⁵]pentadec-8-ene-4,14-dione 2-hydroxy-5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0¹,⁶.0¹²,¹⁵]pentadec-8-ene-4,14-dione 122458-05-3 CC1(C)C2CC=C3COC4OC(=O)C2(C34)C(O)CC1=O InChI=1S/C15H18O5/c1-14(2)8-4-3-7-6-19-12-11(7)15(8,13(18)20-12)10(17)5-9(14)16/h3,8,10-12,17H,4-6H2,1-2H3 UUOCODHGILANAP-UHFFFAOYSA-N belongs to the class of organic compounds known as furofurans. These are organic compounds containing a two furan rings fused to each other. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. Furofurans Organic compounds Organoheterocyclic compounds Furofurans Aliphatic heteropolycyclic compounds Acetals Carboxylic acid esters Cyclic alcohols and derivatives Cyclic ketones Gamma butyrolactones Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Secondary alcohols Tetrahydrofurans Acetal Alcohol Aliphatic heteropolycyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Cyclic alcohol Cyclic ketone Furofuran Gamma butyrolactone Hydrocarbon derivative Ketone Lactone Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Oxacycle Secondary alcohol Tetrahydrofuran logp 0.63 ALOGPS logs -1.43 ALOGPS solubility 1.03e+01 g/l ALOGPS melting_point Mp 247-250° logp 0.88 ChemAxon pka_strongest_acidic 14.21 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 2-hydroxy-5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0¹,⁶.0¹²,¹⁵]pentadec-8-ene-4,14-dione ChemAxon average_mass 278.3004 ChemAxon mono_mass 278.115423686 ChemAxon smiles CC1(C)C2CC=C3COC4OC(=O)C2(C34)C(O)CC1=O ChemAxon formula C15H18O5 ChemAxon inchi InChI=1S/C15H18O5/c1-14(2)8-4-3-7-6-19-12-11(7)15(8,13(18)20-12)10(17)5-9(14)16/h3,8,10-12,17H,4-6H2,1-2H3 ChemAxon inchikey UUOCODHGILANAP-UHFFFAOYSA-N ChemAxon polar_surface_area 72.83 ChemAxon refractivity 69.03 ChemAxon polarizability 27.45 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21825 Specdb::CMs 44702 Specdb::CMs 137923 Specdb::CMs 145657 Specdb::MsMs 9518 Specdb::MsMs 9519 Specdb::MsMs 9520 Specdb::MsMs 16190 Specdb::MsMs 16191 Specdb::MsMs 16192 Specdb::MsMs 2378590 Specdb::MsMs 2378591 Specdb::MsMs 2378592 Specdb::MsMs 2557671 Specdb::MsMs 2557672 Specdb::MsMs 2557673 Specdb::NmrOneD 133358 Specdb::NmrOneD 133359 Specdb::NmrOneD 133360 Specdb::NmrOneD 133361 Specdb::NmrOneD 133362 Specdb::NmrOneD 133363 Specdb::NmrOneD 133364 Specdb::NmrOneD 133365 Specdb::NmrOneD 133366 Specdb::NmrOneD 133367 Specdb::NmrOneD 133368 Specdb::NmrOneD 133369 Specdb::NmrOneD 133370 Specdb::NmrOneD 133371 Specdb::NmrOneD 133372 Specdb::NmrOneD 133373 Specdb::NmrOneD 133374 Specdb::NmrOneD 133375 Specdb::NmrOneD 133376 Specdb::NmrOneD 133377 HMDB36052 #<Reference:0x000055ce3238f008> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322