1.0 2010-04-08 22:05:55 UTC 2025-11-18 22:53:39 UTC FDB003694 Sapogenins Any of the aglycon moieties of saponins; they may be steroids or triterpenes. (ChEBI) Sapogenins are the aglycones, or non-saccharide, portions of the family of natural products known as saponins. Sapogenins contain steroid or other triterpene frameworks as their key organic feature. Sapogenins is found in soft-necked garlic. Sapogenin C27H44O2 400.647 400.334130657 (1'R,2R,2'S,4'S,5S,7'S,8'R,9'S,12'S,13'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane] (1'R,2R,2'S,4'S,5S,7'S,8'R,9'S,12'S,13'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane] [H][C@]12C[C@@]3([H])[C@]4([H])CCC5([H])CCCC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@]([H])(C)[C@@]1(CC[C@]([H])(C)CO1)O2 InChI=1S/C27H44O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h17-24H,5-16H2,1-4H3/t17-,18-,19?,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1 INLFWQCRAJUDCR-IQVMEADQSA-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 Hydrocarbon derivatives Ketals Oxacyclic compounds Oxanes Spirostanes and derivatives Tetrahydrofurans Acetal Aliphatic heteropolycyclic compound Hydrocarbon derivative Ketal Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Spirostane skeleton Steroid Tetrahydrofuran Triterpenoid logp 5.39 ALOGPS logs -7.72 ALOGPS solubility 7.63e-06 g/l ALOGPS logp 6.72 ChemAxon pka_strongest_basic -4 ChemAxon iupac (1'R,2R,2'S,4'S,5S,7'S,8'R,9'S,12'S,13'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane] ChemAxon average_mass 400.647 ChemAxon mono_mass 400.334130657 ChemAxon smiles [H][C@]12C[C@@]3([H])[C@]4([H])CCC5([H])CCCC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@]([H])(C)[C@@]1(CC[C@]([H])(C)CO1)O2 ChemAxon formula C27H44O2 ChemAxon inchi InChI=1S/C27H44O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h17-24H,5-16H2,1-4H3/t17-,18-,19?,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1 ChemAxon inchikey INLFWQCRAJUDCR-IQVMEADQSA-N ChemAxon polar_surface_area 18.46 ChemAxon refractivity 117.75 ChemAxon polarizability 50.02 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 59424 Specdb::MsMs 59425 Specdb::MsMs 59426 Specdb::MsMs 115551 Specdb::MsMs 115552 Specdb::MsMs 115553 Specdb::MsMs 3599414 Specdb::MsMs 3599415 Specdb::MsMs 3599416 Specdb::MsMs 3599417 Specdb::MsMs 3599418 Specdb::MsMs 3599419 26606 Soft-necked garlic Type 1 specific Allium sativum L. var. sativum 4682