1.0 2010-04-08 22:14:52 UTC 2019-11-26 03:18:36 UTC FDB020192 Dictyoquinazol B Alkaloid from Dictyophora indusiata. Dictyoquinazol B is found in mushrooms. 1-Formyl-1,2,3,4-tetrahydro-3-(2-hydroxymethyl-4-methoxyphenyl)-6-methoxyquinazoline Dictyoquinazol B C18H20N2O4 328.3624 328.142307138 3-[2-(hydroxymethyl)-4-methoxyphenyl]-6-methoxy-1,2,3,4-tetrahydroquinazoline-1-carbaldehyde 3-[2-(hydroxymethyl)-4-methoxyphenyl]-6-methoxy-2,4-dihydroquinazoline-1-carbaldehyde COC1=CC=C(N2CN(C=O)C3=CC=C(OC)C=C3C2)C(CO)=C1 InChI=1S/C18H20N2O4/c1-23-15-3-5-17-13(7-15)9-19(11-20(17)12-22)18-6-4-16(24-2)8-14(18)10-21/h3-8,12,21H,9-11H2,1-2H3 ZPMNGXXERQAMJD-UHFFFAOYSA-N belongs to the class of organic compounds known as quinazolines. Quinazolines are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring. Quinazolines Organic compounds Organoheterocyclic compounds Diazanaphthalenes Benzodiazines Aromatic heteropolycyclic compounds Alkyl aryl ethers Anisoles Aromatic alcohols Azacyclic compounds Benzyl alcohols Carbonyl compounds Dialkylarylamines Hydrocarbon derivatives Methoxyanilines Methoxybenzenes Organic oxides Organopnictogen compounds Phenoxy compounds Primary alcohols Tertiary carboxylic acid amides Alcohol Alkyl aryl ether Aniline or substituted anilines Anisole Aromatic alcohol Aromatic heteropolycyclic compound Azacycle Benzenoid Benzyl alcohol Carbonyl group Carboxamide group Carboxylic acid derivative Dialkylarylamine Ether Hydrocarbon derivative Methoxyaniline Methoxybenzene Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol ether Phenoxy compound Primary alcohol Quinazoline Tertiary carboxylic acid amide logp 1.61 ALOGPS logs -2.75 ALOGPS solubility 5.80e-01 g/l ALOGPS logp 1.71 ChemAxon pka_strongest_acidic 14.87 ChemAxon pka_strongest_basic -2.4 ChemAxon iupac 3-[2-(hydroxymethyl)-4-methoxyphenyl]-6-methoxy-1,2,3,4-tetrahydroquinazoline-1-carbaldehyde ChemAxon average_mass 328.3624 ChemAxon mono_mass 328.142307138 ChemAxon smiles COC1=CC=C(N2CN(C=O)C3=CC=C(OC)C=C3C2)C(CO)=C1 ChemAxon formula C18H20N2O4 ChemAxon inchi InChI=1S/C18H20N2O4/c1-23-15-3-5-17-13(7-15)9-19(11-20(17)12-22)18-6-4-16(24-2)8-14(18)10-21/h3-8,12,21H,9-11H2,1-2H3 ChemAxon inchikey ZPMNGXXERQAMJD-UHFFFAOYSA-N ChemAxon polar_surface_area 62.24 ChemAxon refractivity 91.17 ChemAxon polarizability 35.13 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 5 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18828 Specdb::CMs 46773 Specdb::CMs 168854 Specdb::MsMs 307837 Specdb::MsMs 307838 Specdb::MsMs 307839 Specdb::MsMs 351883 Specdb::MsMs 351884 Specdb::MsMs 351885 Specdb::MsMs 2273817 Specdb::MsMs 2273818 Specdb::MsMs 2273819 Specdb::MsMs 3091223 Specdb::MsMs 3091224 Specdb::MsMs 3091225 HMDB40441 #<Reference:0x000055ce31cf44a0> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322