1.0 2010-04-08 22:14:48 UTC 2019-11-26 03:18:29 UTC FDB020106 Ginsenoyne I Found in ginseng roots 9,10-Epoxy-1,4-heptadecadien-6-yn-3-ol C17H26O2 262.3871 262.193280076 (4Z)-8-(3-heptyloxiran-2-yl)octa-1,4-dien-6-yn-3-ol (4Z)-8-(3-heptyloxiran-2-yl)octa-1,4-dien-6-yn-3-ol 141947-40-2 CCCCCCCC1OC1CC#C\C=C/C(O)C=C InChI=1S/C17H26O2/c1-3-5-6-7-10-13-16-17(19-16)14-11-8-9-12-15(18)4-2/h4,9,12,15-18H,2-3,5-7,10,13-14H2,1H3/b12-9- AOXSLJSDFVRCQA-XFXZXTDPSA-N belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms. Fatty alcohols Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohols Aliphatic heteromonocyclic compounds Dialkyl ethers Epoxides Hydrocarbon derivatives Oxacyclic compounds Secondary alcohols Alcohol Aliphatic heteromonocyclic compound Dialkyl ether Ether Fatty alcohol Hydrocarbon derivative Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxirane Secondary alcohol logp 4.81 ALOGPS logs -4.88 ALOGPS solubility 3.46e-03 g/l ALOGPS logp 4.57 ChemAxon pka_strongest_acidic 16.45 ChemAxon pka_strongest_basic -2.2 ChemAxon iupac (4Z)-8-(3-heptyloxiran-2-yl)octa-1,4-dien-6-yn-3-ol ChemAxon average_mass 262.3871 ChemAxon mono_mass 262.193280076 ChemAxon smiles CCCCCCCC1OC1CC#C\C=C/C(O)C=C ChemAxon formula C17H26O2 ChemAxon inchi InChI=1S/C17H26O2/c1-3-5-6-7-10-13-16-17(19-16)14-11-8-9-12-15(18)4-2/h4,9,12,15-18H,2-3,5-7,10,13-14H2,1H3/b12-9- ChemAxon inchikey AOXSLJSDFVRCQA-XFXZXTDPSA-N ChemAxon polar_surface_area 32.76 ChemAxon refractivity 81.42 ChemAxon polarizability 32.52 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 14019 Specdb::CMs 46756 Specdb::CMs 132987 Specdb::CMs 140721 Specdb::MsMs 296962 Specdb::MsMs 296963 Specdb::MsMs 296964 Specdb::MsMs 338356 Specdb::MsMs 338357 Specdb::MsMs 338358 Specdb::MsMs 2439604 Specdb::MsMs 2439605 Specdb::MsMs 2439606 Specdb::MsMs 2523051 Specdb::MsMs 2523052 Specdb::MsMs 2523053 HMDB40374 #<Reference:0x000055ce32e00960> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442