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Farnesol

PubChem CID: 3327

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Compound Synonyms farnesol, 4602-84-0, Farnesyl alcohol, DTXSID3032389, UNII-EB41QIU6JL, Nikkosome, EINECS 225-004-1, NSC 60597, EPA Pesticide Chemical Code 128911, Trimethyl dodecatrienol, AI3-44561, CIS-TRANS-FARNESOL, EB41QIU6JL, Spectrum_001282, (2-trans,6-trans)-farnesol, DTXCID80196591, a farnesol, MFCD00002918, NSC-60597, trans,trans-Farnesol, trans-Farnesol, SpecPlus_000549, Spectrum2_001397, Spectrum3_001070, Spectrum4_001221, 2,6,10-Trimethyl-2,6,10-dodecatrien-12-ol, KBioGR_001682, KBioSS_001762, DivK1c_006645, SPBio_001414, FCI-119A, GTPL3215, CHEMBL4464165, KBio1_001589, KBio2_001762, KBio2_004330, KBio2_006898, KBio3_001880, CRDAMVZIKSXKFV-UHFFFAOYSA-N, Above foot Protect Neymar Jr Unissex, AKOS025244058, DEO PEDICO ABOVE NEYMAR JR MEN, MB00132, USEPA/OPP Pesticide Code: 128910, NCI60_004648, SY038928, SY109350, NS00099595, 2,6,10-DODECATRIEN-1-OL, 3,7,11-TRIMETHYL, 225-004-1
Topological Polar Surface Area 20.2
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 16.0
Isotope Atom Count 0.0
Molecular Complexity 265.0
Database Name cmaup_ingredients;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 3,7,11-trimethyldodeca-2,6,10-trien-1-ol
Prediction Hob 1.0
Xlogp 4.8
Molecular Formula C15H26O
Prediction Swissadme 0.0
Inchi Key CRDAMVZIKSXKFV-UHFFFAOYSA-N
Fcsp3 0.6
Logs -4.091
Rotatable Bond Count 7.0
Logd 3.98
Compound Name Farnesol
Prediction Hob Swissadme 0.0
Exact Mass 222.198
Formal Charge 0.0
Monoisotopic Mass 222.198
Hydrogen Bond Acceptor Count 1.0
Molecular Weight 222.37
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 2.0
Esol -4.1713064
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
Smiles CC(=CCCC(=CCCC(=CCO)C)C)C
Nring 0.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Centella Asiatica (Plant) Rel Props:Source_db:cmaup_ingredients
  • 2. Outgoing r'ship FOUND_IN to/from Curcuma Longa (Plant) Rel Props:Source_db:cmaup_ingredients
  • 3. Outgoing r'ship FOUND_IN to/from Elettaria Cardamomum (Plant) Rel Props:Source_db:cmaup_ingredients
  • 4. Outgoing r'ship FOUND_IN to/from Lonicera Japonica (Plant) Rel Props:Source_db:cmaup_ingredients
  • 5. Outgoing r'ship FOUND_IN to/from Nelumbo Nucifera (Plant) Rel Props:Source_db:cmaup_ingredients
  • 6. Outgoing r'ship FOUND_IN to/from Panax Ginseng (Plant) Rel Props:Source_db:cmaup_ingredients
  • 7. Outgoing r'ship FOUND_IN to/from Schisandra Chinensis (Plant) Rel Props:Source_db:cmaup_ingredients
  • 8. Outgoing r'ship FOUND_IN to/from Zea Mays (Plant) Rel Props:Source_db:cmaup_ingredients