1.0 2010-04-08 22:10:29 UTC 2019-11-26 03:07:53 UTC FDB013033 Camelliagenin C Sapogenin from the seeds of Camellia japonica. Camelliagenin C is found in tea and fats and oils. Camelliagenin C Theasapogenol C C30H50O5 490.715 490.36582471 4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8,9-triol 4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8,9-triol 14440-27-8 CC1(C)CC(O)C2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC34C)C2C1 InChI=1S/C30H50O5/c1-25(2)13-19-18-7-8-21-26(3)11-10-22(33)27(4,16-31)20(26)9-12-28(21,5)29(18,6)15-24(35)30(19,17-32)23(34)14-25/h7,19-24,31-35H,8-17H2,1-6H3 SPCSEMLFKVZFJN-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 homopolycyclic compounds Cyclic alcohols and derivatives Hydrocarbon derivatives Polyols Primary alcohols Secondary alcohols Steroids and steroid derivatives Alcohol Aliphatic homopolycyclic compound Cyclic alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Polyol Primary alcohol Secondary alcohol Steroid Triterpenoid logp 3.43 ALOGPS logs -4.23 ALOGPS solubility 2.87e-02 g/l ALOGPS melting_point Mp 280-283° logp 2.38 ChemAxon pka_strongest_acidic 13.98 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac 4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8,9-triol ChemAxon average_mass 490.715 ChemAxon mono_mass 490.36582471 ChemAxon smiles CC1(C)CC(O)C2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC34C)C2C1 ChemAxon formula C30H50O5 ChemAxon inchi InChI=1S/C30H50O5/c1-25(2)13-19-18-7-8-21-26(3)11-10-22(33)27(4,16-31)20(26)9-12-28(21,5)29(18,6)15-24(35)30(19,17-32)23(34)14-25/h7,19-24,31-35H,8-17H2,1-6H3 ChemAxon inchikey SPCSEMLFKVZFJN-UHFFFAOYSA-N ChemAxon polar_surface_area 101.15 ChemAxon refractivity 138.49 ChemAxon polarizability 57.64 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 5 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21817 Specdb::CMs 43916 Specdb::CMs 131317 Specdb::CMs 139051 Specdb::CMs 164450 Specdb::CMs 164452 Specdb::CMs 164454 Specdb::CMs 164456 Specdb::CMs 164458 Specdb::CMs 280479 Specdb::MsMs 106500 Specdb::MsMs 106501 Specdb::MsMs 106502 Specdb::MsMs 173268 Specdb::MsMs 173269 Specdb::MsMs 173270 Specdb::MsMs 2403875 Specdb::MsMs 2403876 Specdb::MsMs 2403877 Specdb::MsMs 2534265 Specdb::MsMs 2534266 Specdb::MsMs 2534267 HMDB34532 #<Reference:0x000055ce2f38dd28> Black tea Type 1 Fats and oils Unknown generic Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442