1.0 2010-04-08 22:13:24 UTC 2019-11-26 03:15:27 UTC FDB017927 Goshonoside F5 Constituent of Rubus foliolosus (Ceylon raspberry). Goshonoside F5 is found in fruits. Goshonoside F5 C32H54O13 646.7634 646.356441814 2-({2-hydroxy-1,4a-dimethyl-5-[(3E)-3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pent-3-en-1-yl]-6-methylidene-decahydronaphthalen-1-yl}methoxy)-6-(hydroxymethyl)oxane-3,4,5-triol 2-({2-hydroxy-1,4a-dimethyl-5-[(3E)-3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pent-3-en-1-yl]-6-methylidene-hexahydro-2H-naphthalen-1-yl}methoxy)-6-(hydroxymethyl)oxane-3,4,5-triol 90851-28-8 C\C(CCC1C(=C)CCC2C(C)(COC3OC(CO)C(O)C(O)C3O)C(O)CCC12C)=C/COC1OC(CO)C(O)C(O)C1O InChI=1S/C32H54O13/c1-16(10-12-42-29-27(40)25(38)23(36)19(13-33)44-29)5-7-18-17(2)6-8-21-31(18,3)11-9-22(35)32(21,4)15-43-30-28(41)26(39)24(37)20(14-34)45-30/h10,18-30,33-41H,2,5-9,11-15H2,1,3-4H3/b16-10+ QIOMMMCQFIBVKA-MHWRWJLKSA-N belongs to the class of organic compounds known as diterpene glycosides. These are diterpenoids in which an isoprene unit is glycosylated. Diterpene glycosides Organic compounds Lipids and lipid-like molecules Prenol lipids Terpene glycosides Aliphatic heteropolycyclic compounds Acetals Alkyl glycosides Cyclic alcohols and derivatives Diterpenoids Fatty acyl glycosides of mono- and disaccharides Hydrocarbon derivatives Monosaccharides O-glycosyl compounds Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Acetal Alcohol Aliphatic heteropolycyclic compound Alkyl glycoside Cyclic alcohol Diterpene glycoside Diterpenoid Fatty acyl Fatty acyl glycoside Fatty acyl glycoside of mono- or disaccharide Glycosyl compound Hydrocarbon derivative Labdane diterpenoid Monosaccharide O-glycosyl compound Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol logp -0.44 ALOGPS logs -2.93 ALOGPS solubility 7.58e-01 g/l ALOGPS logp -0.89 ChemAxon pka_strongest_acidic 11.91 ChemAxon pka_strongest_basic -3 ChemAxon iupac 2-({2-hydroxy-1,4a-dimethyl-5-[(3E)-3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pent-3-en-1-yl]-6-methylidene-decahydronaphthalen-1-yl}methoxy)-6-(hydroxymethyl)oxane-3,4,5-triol ChemAxon average_mass 646.7634 ChemAxon mono_mass 646.356441814 ChemAxon smiles C\C(CCC1C(=C)CCC2C(C)(COC3OC(CO)C(O)C(O)C3O)C(O)CCC12C)=C/COC1OC(CO)C(O)C(O)C1O ChemAxon formula C32H54O13 ChemAxon inchi InChI=1S/C32H54O13/c1-16(10-12-42-29-27(40)25(38)23(36)19(13-33)44-29)5-7-18-17(2)6-8-21-31(18,3)11-9-22(35)32(21,4)15-43-30-28(41)26(39)24(37)20(14-34)45-30/h10,18-30,33-41H,2,5-9,11-15H2,1,3-4H3/b16-10+ ChemAxon inchikey QIOMMMCQFIBVKA-MHWRWJLKSA-N ChemAxon polar_surface_area 218.99 ChemAxon refractivity 160.17 ChemAxon polarizability 69.64 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 13 ChemAxon donor_count 9 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22667 Specdb::CMs 636604 Specdb::CMs 636605 Specdb::CMs 636606 Specdb::CMs 636607 Specdb::CMs 636608 Specdb::CMs 636609 Specdb::CMs 636610 Specdb::CMs 636611 Specdb::CMs 636612 Specdb::CMs 636613 Specdb::CMs 636614 Specdb::CMs 636615 Specdb::CMs 636616 Specdb::CMs 636617 Specdb::CMs 636618 Specdb::CMs 636619 Specdb::CMs 636620 Specdb::CMs 636621 Specdb::CMs 636622 Specdb::CMs 636623 Specdb::CMs 636624 Specdb::CMs 636625 Specdb::CMs 636626 Specdb::CMs 636627 Specdb::NmrOneD 27162 Specdb::NmrOneD 27163 Specdb::NmrOneD 27164 Specdb::NmrOneD 27165 Specdb::NmrOneD 27166 Specdb::NmrOneD 27167 Specdb::NmrOneD 27168 Specdb::NmrOneD 27169 Specdb::NmrOneD 27170 Specdb::NmrOneD 27171 Specdb::NmrOneD 27172 Specdb::NmrOneD 27173 Specdb::NmrOneD 27174 Specdb::NmrOneD 27175 Specdb::NmrOneD 27176 Specdb::NmrOneD 27177 Specdb::NmrOneD 27178 Specdb::NmrOneD 27179 Specdb::NmrOneD 27180 Specdb::NmrOneD 27181 Specdb::MsMs 101850 Specdb::MsMs 101851 Specdb::MsMs 101852 Specdb::MsMs 167541 Specdb::MsMs 167542 Specdb::MsMs 167543 Specdb::MsMs 2720820 Specdb::MsMs 2720821 Specdb::MsMs 2720822 Specdb::MsMs 2958492 Specdb::MsMs 2958493 Specdb::MsMs 2958494 HMDB38541 #<Reference:0x000055ce31de6048> Fruits Unknown generic