1.0 2010-04-08 22:11:43 UTC 2025-11-19 00:53:24 UTC FDB015232 Oleanolic acid 3-[glucosyl-(1->4)-xyloside] Constituent of the stems of Pisum sativum (pea). Oleanolic acid 3-[glucosyl-(1->4)-xyloside] is found in pulses and common pea. Oleanolic acid 3-[glucosyl-(1->4)-xyloside] Oleanolic acid 3-O-[b-D-glucopyranosyl-(1->4)-b-D-xylopyranoside] C41H66O12 750.9555 750.455427576 10-[(3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid 10-[(3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid 215171-28-1 CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C(C)(C)C5CCC34C)C2C1)C(O)=O InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)53-33-31(46)29(44)24(20-50-33)52-34-32(47)30(45)28(43)23(19-42)51-34/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49) LYHMQMDZVIXWAJ-UHFFFAOYSA-N belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Triterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Triterpenoids Aliphatic heteropolycyclic compounds Acetals Carbonyl compounds Carboxylic acids Disaccharides Hydrocarbon derivatives Monocarboxylic acids and derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Acetal Alcohol Aliphatic heteropolycyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Disaccharide Glycosyl compound Hydrocarbon derivative Monocarboxylic acid or derivatives O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Triterpenoid logp 4.06 ALOGPS logs -4.35 ALOGPS solubility 3.36e-02 g/l ALOGPS logp 3.68 ChemAxon pka_strongest_acidic 4.74 ChemAxon pka_strongest_basic -3 ChemAxon iupac 10-[(3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid ChemAxon average_mass 750.9555 ChemAxon mono_mass 750.455427576 ChemAxon smiles CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C(C)(C)C5CCC34C)C2C1)C(O)=O ChemAxon formula C41H66O12 ChemAxon inchi InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)53-33-31(46)29(44)24(20-50-33)52-34-32(47)30(45)28(43)23(19-42)51-34/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49) ChemAxon inchikey LYHMQMDZVIXWAJ-UHFFFAOYSA-N ChemAxon polar_surface_area 195.6 ChemAxon refractivity 192.49 ChemAxon polarizability 84.32 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 12 ChemAxon donor_count 7 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 777536 Specdb::CMs 777537 Specdb::CMs 777538 Specdb::CMs 777539 Specdb::CMs 777540 Specdb::CMs 777541 Specdb::CMs 777542 Specdb::CMs 777543 Specdb::CMs 777544 Specdb::CMs 777545 Specdb::CMs 777546 Specdb::CMs 777547 Specdb::CMs 777548 Specdb::CMs 777549 Specdb::CMs 777550 Specdb::CMs 777551 Specdb::CMs 777552 Specdb::CMs 777553 Specdb::CMs 777554 Specdb::CMs 777555 Specdb::CMs 777556 Specdb::CMs 777557 Specdb::CMs 777558 Specdb::CMs 777559 Specdb::CMs 777560 Specdb::MsMs 7292 Specdb::MsMs 7293 Specdb::MsMs 7294 Specdb::MsMs 13964 Specdb::MsMs 13965 Specdb::MsMs 13966 Specdb::MsMs 2744829 Specdb::MsMs 2744830 Specdb::MsMs 2744831 Specdb::MsMs 2937070 Specdb::MsMs 2937071 Specdb::MsMs 2937072 HMDB36357 #<Reference:0x000055ce322ed7d0> Common pea Type 1 specific Pisum sativum 3888 Pulses Unknown generic