1.0 2010-04-08 22:10:39 UTC 2019-11-26 03:08:19 UTC FDB013334 Dihydrocapsiate Constituent of fruits of Capsicum annuum. Dihydrocapsiate is found in many foods, some of which are orange bell pepper, herbs and spices, fruits, and italian sweet red pepper. 4-Hydroxy-3-methoxybenzyl 8-methylnonanoate Dihydrocapsiate C18H28O4 308.4125 308.198759384 (4-hydroxy-3-methoxyphenyl)methyl 8-methylnonanoate (4-hydroxy-3-methoxyphenyl)methyl 8-methylnonanoate COC1=C(O)C=CC(COC(=O)CCCCCCC(C)C)=C1 InChI=1S/C18H28O4/c1-14(2)8-6-4-5-7-9-18(20)22-13-15-10-11-16(19)17(12-15)21-3/h10-12,14,19H,4-9,13H2,1-3H3 RBCYRZPENADQGZ-UHFFFAOYSA-N belongs to the class of organic compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Methoxyphenols Organic compounds Benzenoids Phenols Methoxyphenols Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Anisoles Benzyloxycarbonyls Carbonyl compounds Carboxylic acid esters Fatty acid esters Hydrocarbon derivatives Methoxybenzenes Monocarboxylic acids and derivatives Organic oxides Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoid Alkyl aryl ether Anisole Aromatic homomonocyclic compound Benzyloxycarbonyl Carbonyl group Carboxylic acid derivative Carboxylic acid ester Ether Fatty acid ester Fatty acyl Hydrocarbon derivative Methoxybenzene Methoxyphenol Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol ether Phenoxy compound logp 5.00 ALOGPS logs -4.38 ALOGPS solubility 1.29e-02 g/l ALOGPS logp 4.84 ChemAxon pka_strongest_acidic 9.91 ChemAxon pka_strongest_basic -4.9 ChemAxon iupac (4-hydroxy-3-methoxyphenyl)methyl 8-methylnonanoate ChemAxon average_mass 308.4125 ChemAxon mono_mass 308.198759384 ChemAxon smiles COC1=C(O)C=CC(COC(=O)CCCCCCC(C)C)=C1 ChemAxon formula C18H28O4 ChemAxon inchi InChI=1S/C18H28O4/c1-14(2)8-6-4-5-7-9-18(20)22-13-15-10-11-16(19)17(12-15)21-3/h10-12,14,19H,4-9,13H2,1-3H3 ChemAxon inchikey RBCYRZPENADQGZ-UHFFFAOYSA-N ChemAxon polar_surface_area 55.76 ChemAxon refractivity 87.25 ChemAxon polarizability 36.52 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24390 Specdb::CMs 44045 Specdb::CMs 132927 Specdb::CMs 140661 Specdb::MsMs 99048 Specdb::MsMs 99049 Specdb::MsMs 99050 Specdb::MsMs 164127 Specdb::MsMs 164128 Specdb::MsMs 164129 Specdb::MsMs 2684712 Specdb::MsMs 2684713 Specdb::MsMs 2684714 Specdb::MsMs 3024450 Specdb::MsMs 3024451 Specdb::MsMs 3024452 HMDB34781 #<Reference:0x000055ce316afdd8> Fruits Unknown generic Green bell pepper Type 1 specific Capsicum annuum 4072 Herbs and Spices Unknown generic Italian sweet red pepper Type 1 specific Capsicum annuum 4072 Orange bell pepper Type 1 specific Capsicum annuum 4072 Red bell pepper Type 1 specific Capsicum annuum 4072 Yellow bell pepper Type 1 specific Capsicum annuum 4072