1.0 2010-04-08 22:10:35 UTC 2025-11-18 23:42:18 UTC FDB013212 (3alphaOH,20S,24S)-3,19:20,24-Diepoxydammarane-3,25-diol Constituent of Cleome gynandra (cat's whiskers). (3alphaOH,20S,24S)-3,19:20,24-Diepoxydammarane-3,25-diol is found in green vegetables. C30H50O4 474.7156 474.370910088 6-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-9,10,14,14-tetramethyl-16-oxapentacyclo[13.2.2.0¹,¹³.0²,¹⁰.0⁵,⁹]nonadecan-15-ol 6-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-9,10,14,14-tetramethyl-16-oxapentacyclo[13.2.2.0¹,¹³.0²,¹⁰.0⁵,⁹]nonadecan-15-ol 189031-58-1 CC(C)(O)C1CCC(C)(O1)C1CCC2(C)C1CCC1C2(C)CCC2C(C)(C)C3(O)CCC12CO3 InChI=1S/C30H50O4/c1-24(2)21-11-14-27(6)22(29(21)16-17-30(24,32)33-18-29)9-8-19-20(10-13-26(19,27)5)28(7)15-12-23(34-28)25(3,4)31/h19-23,31-32H,8-18H2,1-7H3 VQVGNVXQGAGQRV-UHFFFAOYSA-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 Cyclic alcohols and derivatives Dialkyl ethers Hemiacetals Hydrocarbon derivatives Naphthalenes Naphthopyrans Oxacyclic compounds Oxanes Pyrans Tertiary alcohols Tetrahydrofurans Triterpenoids Alcohol Aliphatic heteropolycyclic compound Cyclic alcohol Dialkyl ether Ether Hemiacetal Hydrocarbon derivative Naphthalene Naphthopyran Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Pyran Tertiary alcohol Tetrahydrofuran Triterpene saponin Triterpenoid logp 4.56 ALOGPS logs -6.59 ALOGPS solubility 1.22e-04 g/l ALOGPS melting_point Mp 108-110° logp 5.32 ChemAxon pka_strongest_acidic 11.68 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 6-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-9,10,14,14-tetramethyl-16-oxapentacyclo[13.2.2.0¹,¹³.0²,¹⁰.0⁵,⁹]nonadecan-15-ol ChemAxon average_mass 474.7156 ChemAxon mono_mass 474.370910088 ChemAxon smiles CC(C)(O)C1CCC(C)(O1)C1CCC2(C)C1CCC1C2(C)CCC2C(C)(C)C3(O)CCC12CO3 ChemAxon formula C30H50O4 ChemAxon inchi InChI=1S/C30H50O4/c1-24(2)21-11-14-27(6)22(29(21)16-17-30(24,32)33-18-29)9-8-19-20(10-13-26(19,27)5)28(7)15-12-23(34-28)25(3,4)31/h19-23,31-32H,8-18H2,1-7H3 ChemAxon inchikey VQVGNVXQGAGQRV-UHFFFAOYSA-N ChemAxon polar_surface_area 58.92 ChemAxon refractivity 134.32 ChemAxon polarizability 56.42 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21470 Specdb::CMs 43994 Specdb::CMs 155166 Specdb::MsMs 12230 Specdb::MsMs 12231 Specdb::MsMs 12232 Specdb::MsMs 18902 Specdb::MsMs 18903 Specdb::MsMs 18904 Specdb::MsMs 2710904 Specdb::MsMs 2710905 Specdb::MsMs 2710906 Specdb::MsMs 2995325 Specdb::MsMs 2995326 Specdb::MsMs 2995327 HMDB34683 #<Reference:0x000055ce323d1cc8> Green vegetables Unknown generic