1.0 2010-04-08 22:11:32 UTC 2019-11-26 03:10:53 UTC FDB014891 Farnesol Component of many flower absolutes [CCD] Farnesol is a natural organic compound which is an acyclic sesquiterpene alcohol found as a colorless liquid. It is insoluble in water, but miscible with oils. It is the building block of most, and possibly all, acyclic sesquiterpenoids and is an important starting compound for organic synthesis. [Wikipedia]. Farnesol is found in many foods, some of which are ginger, cumin, sweet basil, and highbush blueberry. 2,6,10-Dodecatrien-1-ol, 3,7,11-trimethyl- 3,7,11-Trimethyl-2,6,10-dodecatrien-1-ol 3,7,11-Trimethyl-2,6,10-dodecatrienol 3,7,11-Trimethyldodeca-2,6,10-trien-1-ol Farnesol Farnesyl alcohol FCI 119a FEMA 2478 Nikkosome trans,trans-a-Farnesol trans,trans-alpha-Farnesol trans,trans-Farnesol trans,trans-α-farnesol C15H26O 222.3663 222.198365454 (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol (E)-farnesol 4602-84-0 CC(C)=CCC\C(C)=C\CC\C(C)=C\CO InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9+,15-11+ CRDAMVZIKSXKFV-YFVJMOTDSA-N belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. Sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aliphatic acyclic compounds Fatty alcohols Hydrocarbon derivatives Primary alcohols Alcohol Aliphatic acyclic compound Farsesane sesquiterpenoid Fatty acyl Fatty alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Primary alcohol Sesquiterpenoid Acyclic farnesane sesquiterpenoids Other Prenol lipids farnesol Solid logp 4.84 ALOGPS logs -3.58 ALOGPS solubility 5.87e-02 g/l ALOGPS melting_point < 25 oC logp 4.16 ChemAxon pka_strongest_acidic 16.33 ChemAxon pka_strongest_basic -2.2 ChemAxon iupac (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol ChemAxon average_mass 222.3663 ChemAxon mono_mass 222.198365454 ChemAxon smiles CC(C)=CCC\C(C)=C\CC\C(C)=C\CO ChemAxon formula C15H26O ChemAxon inchi InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9+,15-11+ ChemAxon inchikey CRDAMVZIKSXKFV-YFVJMOTDSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 74.98 ChemAxon polarizability 28.7 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 655 Specdb::CMs 1424 Specdb::CMs 1437 Specdb::CMs 1473 Specdb::CMs 2898 Specdb::CMs 31520 Specdb::CMs 31521 Specdb::CMs 31522 Specdb::CMs 38753 Specdb::CMs 132577 Specdb::CMs 140311 Specdb::MsMs 47628 Specdb::MsMs 47629 Specdb::MsMs 47630 Specdb::MsMs 172761 Specdb::MsMs 172762 Specdb::MsMs 172763 Specdb::MsMs 449826 Specdb::MsMs 2438095 Specdb::MsMs 2438096 Specdb::MsMs 2438097 Specdb::MsMs 2528352 Specdb::MsMs 2528353 Specdb::MsMs 2528354 Specdb::NmrOneD 342248 Specdb::NmrOneD 342249 Specdb::NmrOneD 342250 Specdb::NmrOneD 342251 Specdb::NmrOneD 342252 Specdb::NmrOneD 342253 Specdb::NmrOneD 342254 Specdb::NmrOneD 342255 Specdb::NmrOneD 342256 Specdb::NmrOneD 342257 Specdb::NmrOneD 342258 Specdb::NmrOneD 342259 Specdb::NmrOneD 342260 Specdb::NmrOneD 342261 Specdb::NmrOneD 342262 Specdb::NmrOneD 342263 Specdb::NmrOneD 342264 Specdb::NmrOneD 342265 Specdb::NmrOneD 342266 Specdb::NmrOneD 342267 HMDB04305 28600 #<Reference:0x000055ce32aceff8> #<Reference:0x000055ce32acecd8> #<Reference:0x000055ce32ace8f0> #<Reference:0x000055ce32ace710> #<Reference:0x000055ce32ace490> #<Reference:0x000055ce32ace238> #<Reference:0x000055ce32ace058> #<Reference:0x000055ce32acdbd0> #<Reference:0x000055ce32acd8d8> #<Reference:0x000055ce32acd4a0> #<Reference:0x000055ce32acd220> #<Reference:0x000055ce32acceb0> Apple Type 1 specific Malus pumila 283210 Beer Type 2 specific 0.025025 0.05 0.00005 mg/100 g Black tea Type 1 Ceylon cinnamon Type 1 specific Cinnamomum verum 128608 0.75 0.75 0.75 mg/100 g Chinese cinnamon Type 1 specific Cinnamomum aromaticum 119260 Common sage Type 1 specific Salvia officinalis 38868 Cumin Type 1 specific Cuminum cyminum 52462 83.4 83.4 83.4 mg/100 g German camomile Type 1 specific Matricaria recutita 127986 Ginger Type 1 specific Zingiber officinale 94328 Green tea Type 1 Herbal tea Type 1 Highbush blueberry Type 1 specific Vaccinium corymbosum 69266 0.002 0.004 0.0 mg/100 g Lemon grass Type 1 specific Cymbopogon citratus 66014 Pot marjoram Type 1 specific Origanum onites 452416 4.5 4.5 4.5 mg/100 g Red beetroot Type 1 specific Beta vulgaris var. rubra Red raspberry Type 1 specific Rubus idaeus 32247 Red tea Type 1 Roman camomile Type 1 specific Chamaemelum nobile 99037 Spearmint Type 1 specific Mentha spicata 29719 Sweet basil Type 1 specific Ocimum basilicum 39350 Tea Type 1 specific Camellia sinensis 4442 angelica floral fresh linden mild sweet Allergenic 43 A chemical compound which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy. Anti adenomic 86 A substance that inhibits or prevents the proliferation of neoplasms. Anti carcinomic 162 A substance that inhibits or prevents the proliferation of neoplasms. Anti leukemic 393 A substance that inhibits or prevents the proliferation of neoplasms. Anti microbial 436 A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. Anti-cancer 159 A substance that inhibits or prevents the proliferation of neoplasms. Anti-melanomic 425 A substance that inhibits or prevents the proliferation of neoplasms. Anti-spasmodic 619 Any substance introduced into a living organism with therapeutic or diagnostic purpose. Apoptotic 704 Juvabional 1058 Name 936 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. Nematicide 1141 A substance used to destroy pests of the phylum Nematoda (roundworms). Perfumery 1206 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. Pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. Pheromonal 1213 A semiochemical used in olfactory communication between organisms of the same species eliciting a change in sexual or social behaviour. Sedative 1311 A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety. Trichomonicide 1379