1.0 2010-04-08 22:10:35 UTC 2019-11-26 03:08:07 UTC FDB013211 cis-Ferulic acid [arabinosyl-(1->3)-[glucosyl-(1->6)]-glucosyl] ester Constituent of soybean molasses (Glycine species). cis-Ferulic acid [arabinosyl-(1->3)-[glucosyl-(1->6)]-glucosyl] ester is found in pulses. (E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid [a-L-arabinofuranosyl-(1->3)-[b-D-glucopyranosyl-(1->6)]-b-D-glucopyranosyl] ester (E)-Ferulic acid [a-L-arabinofuranosyl-(1->3)-[b-D-glucopyranosyl-(1->6)]-b-D-glucopyranosyl] ester [Arabinosyl-(1->3)-[glucosyl-(1->6)]-glucosyl]-cis-ferulate cis-Ferulic acid [arabinosyl-(1->3)-[glucosyl-(1->6)]-glucosyl] ester C27H38O18 650.5798 650.205814412 4-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-3,5-dihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl (2Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate 4-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-3,5-dihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl (2Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate 328-39-2 COC1=C(O)C=CC(\C=C/C(=O)OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(OC3OC(CO)C(O)C3O)C2O)=C1 InChI=1S/C27H38O18/c1-39-12-6-10(2-4-11(12)30)3-5-16(31)44-27-23(38)24(45-26-21(36)18(33)14(8-29)42-26)19(34)15(43-27)9-40-25-22(37)20(35)17(32)13(7-28)41-25/h2-6,13-15,17-30,32-38H,7-9H2,1H3/b5-3- LUBIAXCXQXWFFZ-HYXAFXHYSA-N belongs to the class of organic compounds known as oligosaccharides. These are carbohydrates made up of 3 to 10 monosaccharide units linked to each other through glycosidic bonds. Oligosaccharides Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Aromatic heteromonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Acetals Alkyl aryl ethers Anisoles Carbonyl compounds Coumaric acids and derivatives Enoate esters Fatty acid esters Hydrocarbon derivatives Hydroxycinnamic acid glycosides Methoxybenzenes Methoxyphenols Monocarboxylic acids and derivatives O-cinnamoyl glycosides O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenoxy compounds Polyols Primary alcohols Secondary alcohols Styrenes Tetrahydrofurans 1-hydroxy-2-unsubstituted benzenoid Acetal Alcohol Alkyl aryl ether Alpha,beta-unsaturated carboxylic ester Anisole Aromatic heteromonocyclic compound Benzenoid Carbonyl group Carboxylic acid derivative Carboxylic acid ester Cinnamic acid ester Cinnamic acid or derivatives Coumaric acid or derivatives Enoate ester Ether Fatty acid ester Fatty acyl Glycosyl compound Hydrocarbon derivative Hydroxycinnamic acid glycoside Hydroxycinnamic acid or derivatives Methoxybenzene Methoxyphenol Monocarboxylic acid or derivatives Monocyclic benzene moiety O-cinnamoyl glycoside O-glycosyl compound Oligosaccharide Organic oxide Organoheterocyclic compound Oxacycle Oxane Phenol Phenol ether Phenoxy compound Polyol Primary alcohol Secondary alcohol Styrene Tetrahydrofuran logp -1.49 ALOGPS logs -1.65 ALOGPS solubility 1.47e+01 g/l ALOGPS logp -3.3 ChemAxon pka_strongest_acidic 9.86 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 4-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-3,5-dihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl (2Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate ChemAxon average_mass 650.5798 ChemAxon mono_mass 650.205814412 ChemAxon smiles COC1=C(O)C=CC(\C=C/C(=O)OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(OC3OC(CO)C(O)C3O)C2O)=C1 ChemAxon formula C27H38O18 ChemAxon inchi InChI=1S/C27H38O18/c1-39-12-6-10(2-4-11(12)30)3-5-16(31)44-27-23(38)24(45-26-21(36)18(33)14(8-29)42-26)19(34)15(43-27)9-40-25-22(37)20(35)17(32)13(7-28)41-25/h2-6,13-15,17-30,32-38H,7-9H2,1H3/b5-3- ChemAxon inchikey LUBIAXCXQXWFFZ-HYXAFXHYSA-N ChemAxon polar_surface_area 283.98 ChemAxon refractivity 142.8 ChemAxon polarizability 62.97 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 17 ChemAxon donor_count 10 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21128 Specdb::CMs 643410 Specdb::CMs 643411 Specdb::CMs 643412 Specdb::CMs 643413 Specdb::CMs 643414 Specdb::CMs 643415 Specdb::CMs 643416 Specdb::CMs 643417 Specdb::CMs 643418 Specdb::CMs 643419 Specdb::CMs 643420 Specdb::CMs 643421 Specdb::CMs 643422 Specdb::CMs 643423 Specdb::CMs 643424 Specdb::CMs 643425 Specdb::CMs 643426 Specdb::CMs 643427 Specdb::CMs 643428 Specdb::CMs 643429 Specdb::CMs 643430 Specdb::CMs 643431 Specdb::CMs 643432 Specdb::CMs 643433 Specdb::MsMs 90381 Specdb::MsMs 90382 Specdb::MsMs 90383 Specdb::MsMs 153522 Specdb::MsMs 153523 Specdb::MsMs 153524 Specdb::MsMs 2431804 Specdb::MsMs 2431805 Specdb::MsMs 2431806 Specdb::MsMs 2503160 Specdb::MsMs 2503161 Specdb::MsMs 2503162 Specdb::NmrOneD 127218 Specdb::NmrOneD 127219 Specdb::NmrOneD 127220 Specdb::NmrOneD 127221 Specdb::NmrOneD 127222 Specdb::NmrOneD 127223 Specdb::NmrOneD 127224 Specdb::NmrOneD 127225 Specdb::NmrOneD 127226 Specdb::NmrOneD 127227 Specdb::NmrOneD 127228 Specdb::NmrOneD 127229 Specdb::NmrOneD 127230 Specdb::NmrOneD 127231 Specdb::NmrOneD 127232 Specdb::NmrOneD 127233 Specdb::NmrOneD 127234 Specdb::NmrOneD 127235 Specdb::NmrOneD 127236 Specdb::NmrOneD 127237 HMDB34682 #<Reference:0x000055ce32c774b8> Pulses Unknown generic