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COCONUT Compound

(-)-cis-Carveol

CNP0250789.3 · C10H16O · View on COCONUT ↗

2D Structure

Download 2D SDF Download 3D SDF

Identifiers

Name(-)-cis-Carveol
IUPAC Name(1~{R},5~{R})-5-isopropenyl-2-methyl-cyclohex-2-en-1-ol
COCONUT IDCNP0250789.3
CAS1197-06-4, 2102-59-2
InChIKeyBAVONGHXFVOKBV-NXEZZACHSA-N
InChIInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3/t9-,10-/m1/s1
SMILESC=C(C)[C@@H]1CC=C(C)[C@H](O)C1

Properties

Molecular FormulaC10H16O
Molecular Weight152.24
Exact Mass152.12012
Log P (ALogP)2.28
TPSA20.23
H-Bond Donors / Acceptors1 / 1
Rotatable Bonds1
Lipinski's Rule of 5 Violations0
QED Drug-likeness0.57
NP-likeness2.97

Classification

NP PathwayTerpenoids
NP SuperclassMonoterpenoids
NP ClassMenthane monoterpenoids
Chemical SuperclassLipids and lipid-like molecules
Chemical ClassPrenol lipids
Chemical SubclassMonoterpenoids

Reported in GR-MAPs Plants

Artemisia annua as “Artemisia annua; Artemisia annua L.” in COCONUT
Foeniculum vulgare as “Foeniculum vulgare” in COCONUT
Daucus carota as “Daucus carota” in COCONUT
Vitex negundo as “Vitex negundo” in COCONUT
Cymbopogon martini as “Cymbopogon martinii” in COCONUT

References (49)

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  2. 10.1002/(SICI)1099-1026(199609)11:5<265::AID-FFJ592>3.0.CO;2-F
  3. 10.1002/CBDV.201400340
  4. 10.1002/FFJ.1248
  5. 10.1016/0031-9422(90)85103-M
  6. 10.1016/0031-9422(92)80396-v
  7. 10.1016/0031-9422(95)00183-8
  8. 10.1016/0305-1978(88)90091-9
  9. 10.1016/J.APJTM.2016.06.009
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  14. 10.1016/S0031-9422(02)00004-3
  15. 10.1016/j.phytochem.2004.08.035
  16. 10.1021/JF00060A013
  17. 10.1021/JF60165A026
  18. 10.1021/JF60201A021
  19. 10.1021/JF9708296
  20. 10.1021/NP50053A047
  21. 10.1055/S-2006-957488
  22. 10.1076/PHBI.35.1.66.13267
  23. 10.1080/10412905.1990.9697828
  24. 10.1080/10412905.1990.9697881
  25. 10.1080/10412905.1991.9697923
  26. 10.1080/10412905.1991.9697971
  27. 10.1080/10412905.1992.9698019
  28. 10.1080/10412905.1992.9698071
  29. 10.1080/10412905.1992.9698111
  30. 10.1080/10412905.1992.9698139
  31. 10.1080/10412905.1993.9698176
  32. 10.1080/10412905.1993.9698244
  33. 10.1080/10412905.1993.9698250
  34. 10.1080/10412905.1994.9698409
  35. 10.1080/10412905.1994.9698446
  36. 10.1080/10412905.1995.9698469
  37. 10.1080/10412905.1995.9698506
  38. 10.1080/10412905.1995.9698514
  39. 10.1080/10412905.1995.9698520
  40. 10.1080/10412905.1997.9700725

Showing 40 of 49. See all references on COCONUT.

Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063. COCONUT release 2026-10.