cis-Chrysanthemol
CNP0189762.3 · C10H18O · View on COCONUT ↗
Identifiers
| Name | cis-Chrysanthemol |
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| IUPAC Name | [(1~{R},3~{S})-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methanol |
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| COCONUT ID | CNP0189762.3 |
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| CAS | 18383-59-0, 78780-10-6 |
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| InChIKey | HIPIENNKVJCMAP-DTWKUNHWSA-N |
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| InChI | InChI=1S/C10H18O/c1-7(2)5-8-9(6-11)10(8,3)4/h5,8-9,11H,6H2,1-4H3/t8-,9+/m0/s1 |
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| SMILES | CC(C)=C[C@H]1[C@@H](CO)C1(C)C |
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Properties
| Molecular Formula | C10H18O |
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| Molecular Weight | 154.25 |
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| Exact Mass | 154.13577 |
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| Log P (ALogP) | 2.22 |
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| TPSA | 20.23 |
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| H-Bond Donors / Acceptors | 1 / 1 |
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| Rotatable Bonds | 2 |
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| Lipinski's Rule of 5 Violations | 0 |
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| QED Drug-likeness | 0.60 |
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| NP-likeness | 2.23 |
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Classification
| NP Pathway | Terpenoids |
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| NP Superclass | Monoterpenoids |
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| NP Class | Monocyclic monoterpenoids |
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| Chemical Superclass | Lipids and lipid-like molecules |
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| Chemical Class | Prenol lipids |
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| Chemical Subclass | Monoterpenoids |
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Reported in GR-MAPs Plants
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.
