1.0 2010-04-08 22:14:10 UTC 2019-11-26 03:17:10 UTC FDB019150 Panaxydol chlorohydrin Isolated from Korean ginseng root. Panaxydol chlorohydrin is found in tea. 1-Heptadecene-4,6-diyne-3,9-diol, 10-chloro- 10-chloro-1-Heptadecene-4,6-diyne-3,9-diol 10-Chloro-3,9-dihydroxyheptadec-1-en-4,6-diyne Panaxydol chlorohydrin C17H25ClO2 296.832 296.154307751 10-chloroheptadec-1-en-4,6-diyne-3,9-diol panaxydol chlorohydrine 111103-92-5 CCCCCCCC(Cl)C(O)CC#CC#CC(O)C=C InChI=1S/C17H25ClO2/c1-3-5-6-7-10-13-16(18)17(20)14-11-8-9-12-15(19)4-2/h4,15-17,19-20H,2-3,5-7,10,13-14H2,1H3 PBNFQEYKZLUTLH-UHFFFAOYSA-N belongs to the class of organic compounds known as chlorohydrins. These are alcohols substituted by a chlorine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl groups. Chlorohydrins Organic compounds Organohalogen compounds Halohydrins Chlorohydrins Aliphatic acyclic compounds Alkyl chlorides Hydrocarbon derivatives Organochlorides Secondary alcohols Alcohol Aliphatic acyclic compound Alkyl chloride Alkyl halide Chlorohydrin Hydrocarbon derivative Organic oxygen compound Organochloride Organooxygen compound Secondary alcohol Fatty alcohols logp 4.77 ALOGPS logs -4.61 ALOGPS solubility 7.21e-03 g/l ALOGPS logp 4.7 ChemAxon pka_strongest_acidic 13.16 ChemAxon pka_strongest_basic -3.4 ChemAxon iupac 10-chloroheptadec-1-en-4,6-diyne-3,9-diol ChemAxon average_mass 296.832 ChemAxon mono_mass 296.154307751 ChemAxon smiles CCCCCCCC(Cl)C(O)CC#CC#CC(O)C=C ChemAxon formula C17H25ClO2 ChemAxon inchi InChI=1S/C17H25ClO2/c1-3-5-6-7-10-13-16(18)17(20)14-11-8-9-12-15(19)4-2/h4,15-17,19-20H,2-3,5-7,10,13-14H2,1H3 ChemAxon inchikey PBNFQEYKZLUTLH-UHFFFAOYSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 86.23 ChemAxon polarizability 34.8 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11825 Specdb::CMs 46451 Specdb::CMs 168208 Specdb::MsMs 47286 Specdb::MsMs 47287 Specdb::MsMs 47288 Specdb::MsMs 118260 Specdb::MsMs 118261 Specdb::MsMs 118262 Specdb::MsMs 2793629 Specdb::MsMs 2793630 Specdb::MsMs 2793631 Specdb::MsMs 2884994 Specdb::MsMs 2884995 Specdb::MsMs 2884996 HMDB39534 #<Reference:0x000055ce322dab80> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442