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.

(E)-1-methylsulfanyl-3-[[(E)-3-methylsulfanylprop-2-enyl]disulfanyl]prop-1-ene

PubChem CID: 11128369

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

ℹ️ Click here to know more about the properties
Ghose Rule True
Classyfire Kingdom Organic compounds
Topological Polar Surface Area 101.0
Hydrogen Bond Donor Count 0.0
Pfizer 3 75 Rule False
Deep Smiles CS/C=C/CSSC/C=C/SC
Heavy Atom Count 12.0
Classyfire Class Organic disulfides
Classyfire Subclass Dialkyldisulfides
Isotope Atom Count 0.0
Molecular Complexity 115.0
Database Name cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name (E)-1-methylsulfanyl-3-[[(E)-3-methylsulfanylprop-2-enyl]disulfanyl]prop-1-ene
Prediction Hob 1.0
Veber Rule True
Classyfire Superclass Organosulfur compounds
Xlogp 2.5
Gsk 4 400 Rule False
Molecular Formula C8H14S4
Prediction Swissadme 0.0
Inchi Key DMYGEKAQMJACKL-GGWOSOGESA-N
Silicos It Class Soluble
Fcsp3 0.5
Logs -4.57
Rotatable Bond Count 7.0
Logd 3.766
Synonyms foetisulfide d
Esol Class Soluble
Functional Groups C/C=C/SC, CSSC
Compound Name (E)-1-methylsulfanyl-3-[[(E)-3-methylsulfanylprop-2-enyl]disulfanyl]prop-1-ene
Prediction Hob Swissadme 0.0
Exact Mass 237.998
Formal Charge 0.0
Monoisotopic Mass 237.998
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 238.5
Gi Absorption True
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 2.0
Lipinski Rule Of 5 True
Esol -2.4441016
Inchi InChI=1S/C8H14S4/c1-9-5-3-7-11-12-8-4-6-10-2/h3-6H,7-8H2,1-2H3/b5-3+,6-4+
Smiles CS/C=C/CSSC/C=C/SC
Nring 0.0
Defined Bond Stereocenter Count 2.0
Egan Rule True

  • 1. Outgoing r'ship FOUND_IN to/from Anagyris Foetida (Plant) Rel Props:Reference:
  • 2. Outgoing r'ship FOUND_IN to/from Cimicifuga Foetida (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Crepis Foetida (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Eria Foetida (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Ferula Alliacea (Plant) Rel Props:Reference:
  • 6. Outgoing r'ship FOUND_IN to/from Ferula Ammoniacum (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Ferula Arrigonii (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Ferula Asafoetida (Plant) Rel Props:Reference:
  • 9. Outgoing r'ship FOUND_IN to/from Ferula Assafoetida (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Ferula Borealis (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Ferula Foetida (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 12. Outgoing r'ship FOUND_IN to/from Ferula Fukanensis (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Ferula Galbaniflua (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Ferula Gummosa (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Ferula Jaeschkeana (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Ferula Kuhistanica (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Ferula Moschata (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Ferula Narther (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Ferula Narthex (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Ferula Oopoda (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Ferula Ovina (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Ferula Persica (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Ferula Polyantha (Plant) Rel Props:Reference:
  • 24. Outgoing r'ship FOUND_IN to/from Ferula Transiliensis (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Furcaria Foetida (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Furcraea Foetida (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Mappia Foetida (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Paederia Foetida (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Passiflora Foetida (Plant) Rel Props:Reference:
  • 30. Outgoing r'ship FOUND_IN to/from Rosa Foetida (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Sterculia Foetida (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Voacanga Foetida (Plant) Rel Props:Reference:
Back to Browse   Back to Home