1.0 2010-04-08 22:13:09 UTC 2019-11-26 03:14:56 UTC FDB017536 Panaxatriol Present in ginseng Panaxatriol is an organic coumpound characterizing a group of ginsenosides. It is a dammarane-type tetracyclic triterpene sapogenin found in ginseng (Panax ginseng) and in notoginseng (Panax pseudoginseng). It is formed by the dehydration of protopanaxatriol. Panaxatriol C30H52O4 476.7315 476.386560152 2,6,6,10,11-pentamethyl-14-(2,6,6-trimethyloxan-2-yl)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-5,8,16-triol 2,6,6,10,11-pentamethyl-14-(2,6,6-trimethyloxan-2-yl)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-5,8,16-triol CC12CCC(C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC21C)C1(C)CCCC(C)(C)O1 InChI=1S/C30H52O4/c1-25(2)12-9-13-30(8,34-25)18-10-15-28(6)23(18)19(31)16-21-27(5)14-11-22(33)26(3,4)24(27)20(32)17-29(21,28)7/h18-24,31-33H,9-17H2,1-8H3 QFJUYMMIBFBOJY-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 12-hydroxysteroids 3-hydroxysteroids 6-hydroxysteroids Cyclic alcohols and derivatives Dialkyl ethers Hydrocarbon derivatives Oxacyclic compounds Oxanes Polyols Secondary alcohols 12-hydroxysteroid 3-hydroxysteroid 6-hydroxysteroid Alcohol Aliphatic heteropolycyclic compound Cyclic alcohol Dialkyl ether Ether Hydrocarbon derivative Hydroxysteroid Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Secondary alcohol Steroid Triterpenoid logp 4.59 ALOGPS logs -5.35 ALOGPS solubility 2.12e-03 g/l ALOGPS melting_point Mp 238-239° logp 4.32 ChemAxon pka_strongest_acidic 14.35 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac 2,6,6,10,11-pentamethyl-14-(2,6,6-trimethyloxan-2-yl)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-5,8,16-triol ChemAxon average_mass 476.7315 ChemAxon mono_mass 476.386560152 ChemAxon smiles CC12CCC(C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC21C)C1(C)CCCC(C)(C)O1 ChemAxon formula C30H52O4 ChemAxon inchi InChI=1S/C30H52O4/c1-25(2)12-9-13-30(8,34-25)18-10-15-28(6)23(18)19(31)16-21-27(5)14-11-22(33)26(3,4)24(27)20(32)17-29(21,28)7/h18-24,31-33H,9-17H2,1-8H3 ChemAxon inchikey QFJUYMMIBFBOJY-UHFFFAOYSA-N ChemAxon polar_surface_area 69.92 ChemAxon refractivity 136.3 ChemAxon polarizability 57.36 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 61917 Specdb::MsMs 61918 Specdb::MsMs 61919 Specdb::MsMs 118539 Specdb::MsMs 118540 Specdb::MsMs 118541 Specdb::MsMs 2786524 Specdb::MsMs 2786525 Specdb::MsMs 2786526 Specdb::MsMs 2923222 Specdb::MsMs 2923223 Specdb::MsMs 2923224 Specdb::CMs 9580 Specdb::CMs 45740 Specdb::CMs 154738 HMDB38244 #<Reference:0x000055ce33332e88> Beverages Unknown generic