1.0 2010-04-08 22:09:43 UTC 2019-11-26 03:05:05 UTC FDB011569 Fusarochromanone Mycotoxin production by Fusarium roseum and the cereal fungus Fusarium equiseti (Fusarium graminearum). Affects growth and development of poultry. Fusarochromanone is found in animal foods. 5-Amino-6-(3-amino-4-hydroxy-1-oxobutyl)-2,3-dihydro-2,2-dimethyl-4H-1-benzopyran-4-one, 9CI Fusarochromenone TDP 1 TDP-1 C15H20N2O4 292.3303 292.142307138 5-amino-6-(3-amino-4-hydroxybutanoyl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one 5-amino-6-(3-amino-4-hydroxybutanoyl)-2,2-dimethyl-3H-1-benzopyran-4-one 104653-89-6 CC1(C)CC(=O)C2=C(O1)C=CC(C(=O)CC(N)CO)=C2N InChI=1S/C15H20N2O4/c1-15(2)6-11(20)13-12(21-15)4-3-9(14(13)17)10(19)5-8(16)7-18/h3-4,8,18H,5-7,16-17H2,1-2H3 COSICWYFCAPPJB-UHFFFAOYSA-N belongs to the class of organic compounds known as 2,2-dimethyl-1-benzopyrans. These are organic compounds containing a 1-benzopyran moiety that carries two methyl groups at the 2-position. 2,2-dimethyl-1-benzopyrans Organic compounds Organoheterocyclic compounds Benzopyrans 1-benzopyrans Aromatic heteropolycyclic compounds 1,2-aminoalcohols Alkyl aryl ethers Aryl alkyl ketones Beta-amino ketones Butyrophenones Chromones Hydrocarbon derivatives Monoalkylamines Organic oxides Organopnictogen compounds Oxacyclic compounds Primary alcohols Vinylogous amides 1,2-aminoalcohol 2,2-dimethyl-1-benzopyran Alcohol Alkyl aryl ether Amine Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Beta-aminoketone Butyrophenone Chromone Ether Hydrocarbon derivative Ketone Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Primary alcohol Primary aliphatic amine Primary amine Vinylogous amide logp 0.29 ALOGPS logs -2.56 ALOGPS solubility 7.97e-01 g/l ALOGPS melting_point Mp 132-134° logp 0.72 ChemAxon pka_strongest_acidic 14.45 ChemAxon pka_strongest_basic 8.92 ChemAxon iupac 5-amino-6-(3-amino-4-hydroxybutanoyl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one ChemAxon average_mass 292.3303 ChemAxon mono_mass 292.142307138 ChemAxon smiles CC1(C)CC(=O)C2=C(O1)C=CC(C(=O)CC(N)CO)=C2N ChemAxon formula C15H20N2O4 ChemAxon inchi InChI=1S/C15H20N2O4/c1-15(2)6-11(20)13-12(21-15)4-3-9(14(13)17)10(19)5-8(16)7-18/h3-4,8,18H,5-7,16-17H2,1-2H3 ChemAxon inchikey COSICWYFCAPPJB-UHFFFAOYSA-N ChemAxon polar_surface_area 115.64 ChemAxon refractivity 79.25 ChemAxon polarizability 30.98 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 6 ChemAxon donor_count 3 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18011 Specdb::CMs 43337 Specdb::CMs 167794 Specdb::MsMs 93399 Specdb::MsMs 93400 Specdb::MsMs 93401 Specdb::MsMs 157158 Specdb::MsMs 157159 Specdb::MsMs 157160 Specdb::MsMs 2306085 Specdb::MsMs 2306086 Specdb::MsMs 2306087 Specdb::MsMs 3063148 Specdb::MsMs 3063149 Specdb::MsMs 3063150 HMDB33514 #<Reference:0x000055ce32b738a0>