1.0 2010-04-08 22:10:28 UTC 2019-11-26 03:07:51 UTC FDB013003 Soyasapogenol C Constituent of soya bean saponin, green gram (Phaseolus radiatus), Trifolium repens (white clover) and other plants. Soyasapogenol C is found in many foods, some of which are herbs and spices, pulses, tea, and green vegetables. (3beta,4beta)-Oleana-12,21-diene-3,23-diol Oleana-12,21-diene-3,23-diol, (3beta,4beta)- Sapogenol C Soyasapogenol C Soyasapogenol M1 C30H48O2 440.7009 440.36543078 4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,11,12,12a,14,14a,14b-octadecahydropicen-3-ol 4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,12,12a,14,14a-dodecahydropicen-3-ol 595-14-2 CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C)C=C1 InChI=1S/C30H48O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,14-15,21-24,31-32H,9-13,16-19H2,1-7H3 VNGUCOGHCJHFID-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 Primary alcohols Secondary alcohols Steroids and steroid derivatives Alcohol Aliphatic homopolycyclic compound Cyclic alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Primary alcohol Secondary alcohol Steroid Triterpenoid logp 6.77 ALOGPS logs -6.03 ALOGPS solubility 4.10e-04 g/l ALOGPS melting_point Mp 238-239° logp 5.76 ChemAxon pka_strongest_acidic 14.49 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac 4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,11,12,12a,14,14a,14b-octadecahydropicen-3-ol ChemAxon average_mass 440.7009 ChemAxon mono_mass 440.36543078 ChemAxon smiles CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C)C=C1 ChemAxon formula C30H48O2 ChemAxon inchi InChI=1S/C30H48O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,14-15,21-24,31-32H,9-13,16-19H2,1-7H3 ChemAxon inchikey VNGUCOGHCJHFID-UHFFFAOYSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 134.8 ChemAxon polarizability 54.31 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15045 Specdb::CMs 43898 Specdb::CMs 160064 Specdb::MsMs 74220 Specdb::MsMs 74221 Specdb::MsMs 74222 Specdb::MsMs 133545 Specdb::MsMs 133546 Specdb::MsMs 133547 Specdb::MsMs 2258459 Specdb::MsMs 2840148 Specdb::MsMs 2840149 Specdb::MsMs 2840150 Specdb::MsMs 2869506 Specdb::MsMs 2869507 Specdb::MsMs 2869508 HMDB34506 #<Reference:0x000055ce3246e6e0> Black tea Type 1 Green tea Type 1 Green vegetables Unknown generic Herbal tea Type 1 Herbs and Spices Unknown generic Pulses Unknown generic Red tea Type 1 Soy bean Type 1 specific Glycine max 3847 Tea Type 1 specific Camellia sinensis 4442