1.0 2010-04-08 22:11:08 UTC 2019-11-26 03:09:40 UTC FDB014215 Ginsenoyne N Constituent of the roots of Panax ginseng (ginseng). Ginsenoyne N is found in tea. C32H46O2 462.7064 462.349780716 (7Z)-14-[5-(3-heptyloxiran-2-yl)penta-1,3-diyn-1-yl]-1,5,5,8-tetramethyl-15-oxatricyclo[9.4.0.0⁴,⁶]pentadeca-7,13-diene (7Z)-14-[5-(3-heptyloxiran-2-yl)penta-1,3-diyn-1-yl]-1,5,5,8-tetramethyl-15-oxatricyclo[9.4.0.0⁴,⁶]pentadeca-7,13-diene CCCCCCCC1OC1CC#CC#CC1=CCC2CC\C(C)=C/C3C(CCC2(C)O1)C3(C)C InChI=1S/C32H46O2/c1-6-7-8-9-12-15-29-30(33-29)16-13-10-11-14-26-20-19-25-18-17-24(2)23-28-27(31(28,3)4)21-22-32(25,5)34-26/h20,23,25,27-30H,6-9,12,15-19,21-22H2,1-5H3/b24-23- VJQQQMJLGGRJCG-VHXPQNKSSA-N belongs to the class of organic compounds known as epoxides. Epoxides are compounds containing a cyclic ether with three ring atoms(one oxygen and two carbon atoms). Epoxides Organic compounds Organoheterocyclic compounds Epoxides Aliphatic heteropolycyclic compounds Dialkyl ethers Hydrocarbon derivatives Oxacyclic compounds Aliphatic heteropolycyclic compound Dialkyl ether Ether Hydrocarbon derivative Organic oxygen compound Organooxygen compound Oxacycle Oxirane logp 8.08 ALOGPS logs -5.94 ALOGPS solubility 5.33e-04 g/l ALOGPS logp 8.42 ChemAxon pka_strongest_acidic 18.63 ChemAxon pka_strongest_basic -4.1 ChemAxon iupac (7Z)-14-[5-(3-heptyloxiran-2-yl)penta-1,3-diyn-1-yl]-1,5,5,8-tetramethyl-15-oxatricyclo[9.4.0.0⁴,⁶]pentadeca-7,13-diene ChemAxon average_mass 462.7064 ChemAxon mono_mass 462.349780716 ChemAxon smiles CCCCCCCC1OC1CC#CC#CC1=CCC2CC\C(C)=C/C3C(CCC2(C)O1)C3(C)C ChemAxon formula C32H46O2 ChemAxon inchi InChI=1S/C32H46O2/c1-6-7-8-9-12-15-29-30(33-29)16-13-10-11-14-26-20-19-25-18-17-24(2)23-28-27(31(28,3)4)21-22-32(25,5)34-26/h20,23,25,27-30H,6-9,12,15-19,21-22H2,1-5H3/b24-23- ChemAxon inchikey VJQQQMJLGGRJCG-VHXPQNKSSA-N ChemAxon polar_surface_area 21.76 ChemAxon refractivity 145.26 ChemAxon polarizability 59.83 ChemAxon rotatable_bond_count 10 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24264 Specdb::CMs 163421 Specdb::MsMs 99186 Specdb::MsMs 99187 Specdb::MsMs 99188 Specdb::MsMs 164289 Specdb::MsMs 164290 Specdb::MsMs 164291 Specdb::MsMs 2741926 Specdb::MsMs 2741927 Specdb::MsMs 2741928 Specdb::MsMs 2940836 Specdb::MsMs 2940837 Specdb::MsMs 2940838 HMDB35523 #<Reference:0x000055ce31c0c240> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442