Chrysantherol

PubChem CID: 46173954

Connections displayed (default: 10).

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Compound Synonyms	Chrysantherol, 4-methyl-10-methylidene-7-prop-1-en-2-yl-11-oxatricyclo(6.2.1.04,9)undecan-9-ol, 4-methyl-10-methylidene-7-prop-1-en-2-yl-11-oxatricyclo[6.2.1.04,9]undecan-9-ol, CHEBI:81215, C17609, Q27155161
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	1.0
Pfizer 3 75 Rule	False
Scaffold Graph Level	CC1C2CCC3CCCC(C2)C31
Np Classifier Class	Eudesmane sesquiterpenoids
Deep Smiles	CC=C)CCCCCC6OCC5=C))CC7)))))O))C
Heavy Atom Count	17.0
Classyfire Class	Prenol lipids
Scaffold Graph Node Level	CC1C2CCC3CCCC(O2)C31
Classyfire Subclass	Sesquiterpenoids
Isotope Atom Count	0.0
Molecular Complexity	400.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	4-methyl-10-methylidene-7-prop-1-en-2-yl-11-oxatricyclo[6.2.1.04,9]undecan-9-ol
Prediction Hob	0.0
Veber Rule	True
Classyfire Superclass	Lipids and lipid-like molecules
Xlogp	2.3
Gsk 4 400 Rule	True
Molecular Formula	C15H22O2
Scaffold Graph Node Bond Level	C=C1C2CCC3CCCC(O2)C13
Prediction Swissadme	1.0
Inchi Key	IMIAOSAKRWYJIZ-UHFFFAOYSA-N
Silicos It Class	Soluble
Fcsp3	0.7333333333333333
Logs	-4.092
Rotatable Bond Count	1.0
Logd	3.23
Synonyms	chrysantherol
Esol Class	Soluble
Functional Groups	C=C(C)C, CO, COC
Compound Name	Chrysantherol
Prediction Hob Swissadme	0.0
Exact Mass	234.162
Formal Charge	0.0
Monoisotopic Mass	234.162
Hydrogen Bond Acceptor Count	2.0
Molecular Weight	234.33
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	5.0
Total Bond Stereocenter Count	0.0
Lipinski Rule Of 5	True
Esol	-2.7011018
Inchi	InChI=1S/C15H22O2/c1-9(2)11-5-7-14(4)8-6-12-10(3)15(14,16)13(11)17-12/h11-13,16H,1,3,5-8H2,2,4H3
Smiles	CC(=C)C1CCC2(CCC3C(=C)C2(C1O3)O)C
Nring	3.0
Np Classifier Biosynthetic Pathway	Terpenoids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Sesquiterpenoids

1. Outgoing r'ship FOUND_IN to/from Abutilon Indicum (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Arthrocnemum Indicum (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Bryodesma Indicum (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Canarium Indicum (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Cerastium Indicum (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Chrysanthellum Indicum (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Chrysanthemum Boreale (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Chrysanthemum Coronarium (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Chrysanthemum Griffithii (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Chrysanthemum Indicum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
11. Outgoing r'ship FOUND_IN to/from Chrysanthemum Lavandulifolium (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Chrysanthemum Leptophyllum (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Chrysanthemum Morifolium (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Chrysanthemum Myconis (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Chrysanthemum Pyrethroides (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Chrysanthemum Sinense (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Chrysanthemum Tibeticum (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Chrysanthemum Uliginosum (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Chrysanthemum X (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Chrysanthemum Zawadskii (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Claoxylon Indicum (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Clerodendron Indicum (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Clerodendrum Indicum (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Combretum Indicum (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Distemon Indicum (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Gnaphalium Indicum (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Gossypium Indicum (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Heliophylum Indicum (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Heliotropium Indicum (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Jasminum Chrysanthemum (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Limeum Indicum (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Limnanthemum Indicum (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Melanthium Indicum (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Melilotus Indicus (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Nasturtium Indicum (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Nerium Indicum (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Nymphoides Indicum (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Oroxylum Indicum (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Pentanema Indicum (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Phyllocephalum Indicum (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Poeciloneuron Indicum (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Sandoricum Indicum (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Sapium Indicum (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Sesamum Indicum (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Seseli Indicum (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Solanum Indicum (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Tiaridium Indicum (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Trichodesma Indicum (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Xanthium Indicum (Plant) Rel Props:Reference:

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Phytochemical Properties

Associated Connections 49

Plant Connections 49