1.0 2010-04-08 22:13:51 UTC 2019-11-26 03:16:27 UTC FDB018652 Ginsenoyne B Present in ginseng root. Ginsenoyne B is found in tea. Ginsenoyne B C17H23ClO2 294.816 294.138657687 10-chloroheptadeca-1,16-dien-4,6-diyne-3,9-diol 10-chloroheptadeca-1,16-dien-4,6-diyne-3,9-diol 139035-29-3 OC(C=C)C#CC#CCC(O)C(Cl)CCCCCC=C InChI=1S/C17H23ClO2/c1-3-5-6-7-10-13-16(18)17(20)14-11-8-9-12-15(19)4-2/h3-4,15-17,19-20H,1-2,5-7,10,13-14H2 MORPELUWUARUFU-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 logp 4.16 ALOGPS logs -4.52 ALOGPS solubility 8.90e-03 g/l ALOGPS logp 4.4 ChemAxon pka_strongest_acidic 13.16 ChemAxon pka_strongest_basic -3.4 ChemAxon iupac 10-chloroheptadeca-1,16-dien-4,6-diyne-3,9-diol ChemAxon average_mass 294.816 ChemAxon mono_mass 294.138657687 ChemAxon smiles OC(C=C)C#CC#CCC(O)C(Cl)CCCCCC=C ChemAxon formula C17H23ClO2 ChemAxon inchi InChI=1S/C17H23ClO2/c1-3-5-6-7-10-13-16(18)17(20)14-11-8-9-12-15(19)4-2/h3-4,15-17,19-20H,1-2,5-7,10,13-14H2 ChemAxon inchikey MORPELUWUARUFU-UHFFFAOYSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 86.27 ChemAxon polarizability 33.97 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23521 Specdb::CMs 46277 Specdb::CMs 174334 Specdb::MsMs 95961 Specdb::MsMs 95962 Specdb::MsMs 95963 Specdb::MsMs 160344 Specdb::MsMs 160345 Specdb::MsMs 160346 Specdb::MsMs 2277530 Specdb::MsMs 2277531 Specdb::MsMs 2277532 Specdb::MsMs 3088738 Specdb::MsMs 3088739 Specdb::MsMs 3088740 HMDB39134 #<Reference:0x000055ce3363b440> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442