This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration. This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration.

13-Heptadecyn-1-ol

PubChem CID: 557439

Connections displayed (default: 10).
Loading graph...

ℹ️ Click here to know more about the properties
Compound Synonyms 13-Heptadecyn-1-ol, heptadec-13-yn-1-ol, 56554-77-9, UA6AXD5AX6, SCHEMBL18614852, CHEBI:172494, DZJZIJZUKAATIV-UHFFFAOYSA-N, DB-259344
Ghose Rule True
Classyfire Kingdom Organic compounds
Topological Polar Surface Area 20.2
Hydrogen Bond Donor Count 1.0
Pfizer 3 75 Rule False
Np Classifier Class Fatty alcohols
Deep Smiles OCCCCCCCCCCCCC#CCCC
Heavy Atom Count 18.0
Classyfire Class Fatty acyls
Classyfire Subclass Fatty alcohols
Isotope Atom Count 0.0
Molecular Complexity 208.0
Database Name cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name heptadec-13-yn-1-ol
Prediction Hob 1.0
Class Fatty Acyls
Veber Rule False
Classyfire Superclass Lipids and lipid-like molecules
Xlogp 6.7
Superclass Lipids and lipid-like molecules
Subclass Fatty alcohols
Gsk 4 400 Rule False
Molecular Formula C17H32O
Prediction Swissadme 0.0
Inchi Key DZJZIJZUKAATIV-UHFFFAOYSA-N
Silicos It Class Moderately soluble
Fcsp3 0.8823529411764706
Logs -5.748
Rotatable Bond Count 12.0
Logd 3.774
Synonyms Heptadec-13-yn-1-ol, 13-heptadecyn-1-ol
Esol Class Moderately soluble
Functional Groups CC#CC, CO
Compound Name 13-Heptadecyn-1-ol
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 252.245
Formal Charge 0.0
Monoisotopic Mass 252.245
Hydrogen Bond Acceptor Count 1.0
Molecular Weight 252.4
Gi Absorption True
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aliphatic acyclic compounds
Lipinski Rule Of 5 True
Esol -4.8026404
Inchi InChI=1S/C17H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h18H,2-3,6-17H2,1H3
Smiles CCCC#CCCCCCCCCCCCCO
Nring 0.0
Np Classifier Biosynthetic Pathway Fatty acids
Defined Bond Stereocenter Count 0.0
Egan Rule True
Taxonomy Direct Parent Long-chain fatty alcohols
Np Classifier Superclass Fatty acyls

  • 1. Outgoing r'ship FOUND_IN to/from Anastatica Hierochuntica (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2018.1504695
  • 2. Outgoing r'ship FOUND_IN to/from Annona Reticulata (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Aristolochia Reticulata (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Citrus Acida (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Citrus Aurantiifolia (Plant) Rel Props:Reference:
  • 6. Outgoing r'ship FOUND_IN to/from Citrus Aurantium (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Citrus Bergamia (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Citrus Chachiensis (Plant) Rel Props:Reference:
  • 9. Outgoing r'ship FOUND_IN to/from Citrus Decumana (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Citrus Erythrosa (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Citrus Funadoko (Plant) Rel Props:Reference:
  • 12. Outgoing r'ship FOUND_IN to/from Citrus Glauca (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Citrus Grandis (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Citrus Hassaku (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Citrus Hybr (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Citrus Hystrix (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Citrus Indica (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Citrus Jambhiri (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Citrus Japonica (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Citrus Junos (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Citrus Latifolia (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Citrus Latipes (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Citrus Limon (Plant) Rel Props:Reference:
  • 24. Outgoing r'ship FOUND_IN to/from Citrus Limonia (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Citrus Maxima (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Citrus Medica (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Citrus Mitis (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Citrus Natsudaidai (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Citrus Nobilis (Plant) Rel Props:Reference:
  • 30. Outgoing r'ship FOUND_IN to/from Citrus Paradisi (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Citrus Pennivesiculata (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Citrus Pseudolimon (Plant) Rel Props:Reference:
  • 33. Outgoing r'ship FOUND_IN to/from Citrus Reshni (Plant) Rel Props:Reference:
  • 34. Outgoing r'ship FOUND_IN to/from Citrus Reticulata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all; Reference:
  • 35. Outgoing r'ship FOUND_IN to/from Citrus Rugulosa (Plant) Rel Props:Reference:
  • 36. Outgoing r'ship FOUND_IN to/from Citrus Sinensis (Plant) Rel Props:Reference:
  • 37. Outgoing r'ship FOUND_IN to/from Citrus Sudachii (Plant) Rel Props:Reference:
  • 38. Outgoing r'ship FOUND_IN to/from Citrus Tachibana (Plant) Rel Props:Reference:
  • 39. Outgoing r'ship FOUND_IN to/from Citrus Tamurana (Plant) Rel Props:Reference:
  • 40. Outgoing r'ship FOUND_IN to/from Citrus Tangemna (Plant) Rel Props:Reference:
  • 41. Outgoing r'ship FOUND_IN to/from Citrus Tangerina (Plant) Rel Props:Reference:
  • 42. Outgoing r'ship FOUND_IN to/from Citrus Tankan (Plant) Rel Props:Reference:
  • 43. Outgoing r'ship FOUND_IN to/from Citrus Trifoliata (Plant) Rel Props:Reference:
  • 44. Outgoing r'ship FOUND_IN to/from Citrus Unshiu (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 45. Outgoing r'ship FOUND_IN to/from Citrus Wilsonii (Plant) Rel Props:Reference:
  • 46. Outgoing r'ship FOUND_IN to/from Citrus X (Plant) Rel Props:Reference:
  • 47. Outgoing r'ship FOUND_IN to/from Citrus Yuko (Plant) Rel Props:Reference:
  • 48. Outgoing r'ship FOUND_IN to/from Derris Reticulata (Plant) Rel Props:Reference:
  • 49. Outgoing r'ship FOUND_IN to/from Leptadenia Reticulata (Plant) Rel Props:Reference:
  • 50. Outgoing r'ship FOUND_IN to/from Millettia Reticulata (Plant) Rel Props:Reference:
  • 51. Outgoing r'ship FOUND_IN to/from Morinda Reticulata (Plant) Rel Props:Reference:
  • 52. Outgoing r'ship FOUND_IN to/from Plathymenia Reticulata (Plant) Rel Props:Reference:
  • 53. Outgoing r'ship FOUND_IN to/from Sacia Reticulata (Plant) Rel Props:Reference:
  • 54. Outgoing r'ship FOUND_IN to/from Salacia Reticulata (Plant) Rel Props:Reference:
  • 55. Outgoing r'ship FOUND_IN to/from Utricularia Reticulata (Plant) Rel Props:Reference:
Back to Browse   Back to Home