1.0 2010-04-08 22:15:08 UTC 2018-05-29 01:47:22 UTC FDB020596 Vinaginsenoside R10 Constituent of Panax vietnamensis (Vietnamese ginseng) Vinaginsenoside R10 C36H62O10 654.8715 654.434298204 (2R,3R,4S,5S,6R)-2-{[(2R,5S,8S,10R,11R,16R)-5,16-dihydroxy-14-[(2S,5R)-5-hydroxy-2,6,6-trimethyloxan-2-yl]-2,6,6,10,11-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-8-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol (2R,3R,4S,5S,6R)-2-{[(2R,5S,8S,10R,11R,16R)-5,16-dihydroxy-14-[(2S,5R)-5-hydroxy-2,6,6-trimethyloxan-2-yl]-2,6,6,10,11-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-8-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol 156398-69-5 C[C@@]12CCC(C1[C@H](O)CC1[C@@]3(C)CC[C@H](O)C(C)(C)C3[C@H](C[C@@]21C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(C)CC[C@@H](O)C(C)(C)O1 InChI=1S/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(40)32(3,4)46-36)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(43)27(42)26(41)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18?,19-,20+,21-,22?,23+,24-,25?,26-,27+,28-,29?,30-,33-,34-,35-,36+/m1/s1 CFOKFXFKMQABRM-PMRPHTDHSA-N belongs to the class of organic compounds known as triterpene saponins. These are glycosylated derivatives of triterpene sapogenins. The sapogenin moiety backbone is usually based on the oleanane, ursane, taraxastane, bauerane, lanostane, lupeol, lupane, dammarane, cycloartane, friedelane, hopane, 9b,19-cyclo-lanostane, cycloartane, or cycloartanol skeleton. Triterpene saponins Organic compounds Lipids and lipid-like molecules Prenol lipids Terpene glycosides Aliphatic heteropolycyclic compounds 12-hydroxysteroids 14-alpha-methylsteroids 3-beta-hydroxysteroids Acetals Cyclic alcohols and derivatives Dialkyl ethers Hydrocarbon derivatives Monosaccharides O-glycosyl compounds Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Triterpenoids 12-hydroxysteroid 14-alpha-methylsteroid 24-hydroxysteroid 3-beta-hydroxysteroid 3-hydroxysteroid Acetal Alcohol Aliphatic heteropolycyclic compound Cyclic alcohol Dialkyl ether Ether Glycosyl compound Hydrocarbon derivative Hydroxysteroid Monosaccharide O-glycosyl compound Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Steroid Triterpene saponin Triterpenoid logp 2.07 ALOGPS logs -3.90 ALOGPS solubility 8.32e-02 g/l ALOGPS melting_point Mp 257-259° logp 1.47 ChemAxon pka_strongest_acidic 12.2 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac (2R,3R,4S,5S,6R)-2-{[(2R,5S,8S,10R,11R,16R)-5,16-dihydroxy-14-[(2S,5R)-5-hydroxy-2,6,6-trimethyloxan-2-yl]-2,6,6,10,11-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-8-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol ChemAxon average_mass 654.8715 ChemAxon mono_mass 654.434298204 ChemAxon smiles C[C@@]12CCC(C1[C@H](O)CC1[C@@]3(C)CC[C@H](O)C(C)(C)C3[C@H](C[C@@]21C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(C)CC[C@@H](O)C(C)(C)O1 ChemAxon formula C36H62O10 ChemAxon inchi InChI=1S/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(40)32(3,4)46-36)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(43)27(42)26(41)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18?,19-,20+,21-,22?,23+,24-,25?,26-,27+,28-,29?,30-,33-,34-,35-,36+/m1/s1 ChemAxon inchikey CFOKFXFKMQABRM-PMRPHTDHSA-N ChemAxon polar_surface_area 169.3 ChemAxon refractivity 170.08 ChemAxon polarizability 72.72 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 10 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon HMDB40780 #<Reference:0x000055ce31e1f0a0>