Mintketone

PubChem CID: 15118057

Connections displayed (default: 10).

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Compound Synonyms	4(14)-Salvialen-1-one, 7(14)-Isodaucen-10-one, (1S,3aR,8aS)-1-Isopropyl-3a-methyl-7-methyleneoctahydroazulen-4(2H)-one, 4(1H)-Azulenone, octahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, [1S-(1.alpha.,3a.alpha.,8a.alpha.)]-, Salvial-4(14)-ene-1-one, CHEBI:169708, Q67879622, 3a-methyl-7-methylidene-1-propan-2-yl-2,3,5,6,8,8a-hexahydro-1H-azulen-4-one, 4(1H)-Azulenone, octahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,8aalpha))-
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0.0
Heavy Atom Count	16.0
Description	Constituent of Clary sage oil (Salvia sclarea). 7(14)-Isodaucen-10-one is found in herbs and spices.
Isotope Atom Count	0.0
Molecular Complexity	315.0
Database Name	cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	3a-methyl-7-methylidene-1-propan-2-yl-2,3,5,6,8,8a-hexahydro-1H-azulen-4-one
Prediction Hob	0.0
Class	Prenol lipids
Xlogp	3.6
Superclass	Lipids and lipid-like molecules
Subclass	Sesquiterpenoids
Molecular Formula	C15H24O
Prediction Swissadme	0.0
Inchi Key	JBOONPKUPONSIB-UHFFFAOYSA-N
Fcsp3	0.8
Logs	-3.702
Rotatable Bond Count	1.0
State	Solid
Logd	3.573
Synonyms	4(14)-Salvialen-1-one, salvial-4(14)-ene-1-one, Salvial-4(14)-ene-1-one
Compound Name	Mintketone
Kingdom	Organic compounds
Prediction Hob Swissadme	0.0
Exact Mass	220.183
Formal Charge	0.0
Monoisotopic Mass	220.183
Hydrogen Bond Acceptor Count	1.0
Molecular Weight	220.35
Covalent Unit Count	1.0
Total Atom Stereocenter Count	3.0
Total Bond Stereocenter Count	0.0
Molecular Framework	Aliphatic homopolycyclic compounds
Esol	-3.3956071999999997
Inchi	InChI=1S/C15H24O/c1-10(2)12-7-8-15(4)13(12)9-11(3)5-6-14(15)16/h10,12-13H,3,5-9H2,1-2,4H3
Smiles	CC(C)C1CCC2(C1CC(=C)CCC2=O)C
Nring	2.0
Defined Bond Stereocenter Count	0.0
Taxonomy Direct Parent	Germacrane sesquiterpenoids

1. Outgoing r'ship FOUND_IN to/from Haplophyllum Perforatum (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Hyoscyamus Perforatum (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Hypericum Ancherii (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Hypericum Androsaemum (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Hypericum Annulatum (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Hypericum Ascyron (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Hypericum Aucheri (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Hypericum Balearicum (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Hypericum Calycinum (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Hypericum Caprifoliatum (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Hypericum Carinatum (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Hypericum Chinense (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Hypericum Choisianum (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Hypericum Degenii (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Hypericum Drummondii (Plant) Rel Props:Reference:
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18. Outgoing r'ship FOUND_IN to/from Hypericum Faberi (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Hypericum Foliosum (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Hypericum Geminiflorum (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Hypericum Henryi (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Hypericum Hirsutum (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Hypericum Hookerianum (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Hypericum Humifusum (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Hypericum Japonicum (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Hypericum Jovis (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Hypericum Laricifolium (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Hypericum Monanthemum (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Hypericum Monogynum (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Hypericum Mysorense (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Hypericum Mysurense (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Hypericum Oblongifolium (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Hypericum Olympicum (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Hypericum Papuanum (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Hypericum Patulum (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Hypericum Perforatum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
37. Outgoing r'ship FOUND_IN to/from Hypericum Polyanthemum (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Hypericum Prolificum (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Hypericum Reflexum (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Hypericum Reptans (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Hypericum Revolutum (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Hypericum Sampsonii (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Hypericum Scabrum (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Hypericum Sikokumontanum (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Hypericum Styphelioides (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Hypericum Triquetrifolium (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Hypericum Uralum (Plant) Rel Props:Reference:

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Phytochemical Properties

Associated Connections 47

Plant Connections 47