1.0 2010-04-08 22:09:26 UTC 2025-11-18 23:24:03 UTC FDB011032 Corchorusoside C Constituent of Corchorus olitorius (Jew's mallow). Corchorusoside C is found in tea, herbs and spices, and green vegetables. Corchorusoside C C35H54O13 682.7955 682.356441814 4-{7,11-dihydroxy-5-[(4-hydroxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl}-2,5-dihydrofuran-2-one 4-{7,11-dihydroxy-5-[(4-hydroxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl}-5H-furan-2-one 210637-17-5 CC1OC(CC(O)C1OC1OC(CO)C(O)C(O)C1O)OC1CCC2(C)C3CCC4(C)C(CCC4(O)C3CCC2(O)C1)C1=CC(=O)OC1 InChI=1S/C35H54O13/c1-17-30(48-31-29(41)28(40)27(39)24(15-36)47-31)23(37)13-26(45-17)46-19-4-8-32(2)21-5-9-33(3)20(18-12-25(38)44-16-18)7-11-35(33,43)22(21)6-10-34(32,42)14-19/h12,17,19-24,26-31,36-37,39-43H,4-11,13-16H2,1-3H3 ZOSJMTBTUZXPSR-UHFFFAOYSA-N belongs to the class of organic compounds known as cardenolide glycosides and derivatives. Cardenolide glycosides and derivatives are compounds containing a carbohydrate glycosidically bound to the cardenolide moiety. Cardenolide glycosides and derivatives Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Steroid lactones Aliphatic heteropolycyclic compounds 14-hydroxysteroids Acetals Butenolides Carbonyl compounds Cyclic alcohols and derivatives Disaccharides Enoate esters Hydrocarbon derivatives Lactones Monocarboxylic acids and derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Steroidal glycosides Tertiary alcohols 14-hydroxysteroid 2-furanone 5-hydroxysteroid Acetal Alcohol Aliphatic heteropolycyclic compound Alpha,beta-unsaturated carboxylic ester Carbonyl group Carboxylic acid derivative Carboxylic acid ester Cardanolide-glycoside Cyclic alcohol Dihydrofuran Disaccharide Enoate ester Glycosyl compound Hydrocarbon derivative Hydroxysteroid Lactone Monocarboxylic acid or derivatives O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Steroidal glycoside Tertiary alcohol logp -0.36 ALOGPS logs -3.30 ALOGPS solubility 3.46e-01 g/l ALOGPS logp 0.24 ChemAxon pka_strongest_acidic 7.18 ChemAxon pka_strongest_basic 0.24 ChemAxon iupac 4-{7,11-dihydroxy-5-[(4-hydroxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl}-2,5-dihydrofuran-2-one ChemAxon average_mass 682.7955 ChemAxon mono_mass 682.356441814 ChemAxon smiles CC1OC(CC(O)C1OC1OC(CO)C(O)C(O)C1O)OC1CCC2(C)C3CCC4(C)C(CCC4(O)C3CCC2(O)C1)C1=CC(=O)OC1 ChemAxon formula C35H54O13 ChemAxon inchi InChI=1S/C35H54O13/c1-17-30(48-31-29(41)28(40)27(39)24(15-36)47-31)23(37)13-26(45-17)46-19-4-8-32(2)21-5-9-33(3)20(18-12-25(38)44-16-18)7-11-35(33,43)22(21)6-10-34(32,42)14-19/h12,17,19-24,26-31,36-37,39-43H,4-11,13-16H2,1-3H3 ChemAxon inchikey ZOSJMTBTUZXPSR-UHFFFAOYSA-N ChemAxon polar_surface_area 204.83 ChemAxon refractivity 166.9 ChemAxon polarizability 73.13 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 12 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 67437 Specdb::MsMs 67438 Specdb::MsMs 67439 Specdb::MsMs 125256 Specdb::MsMs 125257 Specdb::MsMs 125258 Specdb::MsMs 2450971 Specdb::MsMs 2450972 Specdb::MsMs 2450973 Specdb::MsMs 2487288 Specdb::MsMs 2487289 Specdb::MsMs 2487290 Specdb::NmrOneD 117518 Specdb::NmrOneD 117519 Specdb::NmrOneD 117520 Specdb::NmrOneD 117521 Specdb::NmrOneD 117522 Specdb::NmrOneD 117523 Specdb::NmrOneD 117524 Specdb::NmrOneD 117525 Specdb::NmrOneD 117526 Specdb::NmrOneD 117527 Specdb::NmrOneD 117528 Specdb::NmrOneD 117529 Specdb::NmrOneD 117530 Specdb::NmrOneD 117531 Specdb::NmrOneD 117532 Specdb::NmrOneD 117533 Specdb::NmrOneD 117534 Specdb::NmrOneD 117535 Specdb::NmrOneD 117536 Specdb::NmrOneD 117537 Specdb::CMs 730788 Specdb::CMs 730789 Specdb::CMs 730790 Specdb::CMs 730791 Specdb::CMs 730792 Specdb::CMs 730793 Specdb::CMs 730794 Specdb::CMs 730795 Specdb::CMs 730796 Specdb::CMs 730797 Specdb::CMs 730798 Specdb::CMs 730799 Specdb::CMs 730800 Specdb::CMs 730801 Specdb::CMs 730802 Specdb::CMs 730803 Specdb::CMs 730804 Specdb::CMs 730805 Specdb::CMs 730806 Specdb::CMs 730807 Specdb::CMs 730808 Specdb::CMs 730809 Specdb::CMs 730810 Specdb::CMs 730811 Specdb::CMs 730812 HMDB33039 #<Reference:0x00007f093c0f8bf0> Black tea Type 1 Green tea Type 1 Green vegetables Unknown generic Herbal tea Type 1 Herbs and Spices Unknown generic Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442