| Record Information |
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| Version | 1.0 |
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| Created at | 2020-04-17 19:32:35 UTC |
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| Updated at | 2020-12-07 19:11:58 UTC |
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| CannabisDB ID | CDB005332 |
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| Secondary Accession Numbers | Not Available |
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| Cannabis Compound Identification |
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| Common Name | Cycloartenol |
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| Description | Cycloartenol, also known as artosenol or handianol, belongs to the class of organic compounds known as cycloartanols and derivatives. These are steroids containing a cycloartanol moiety. Cycloartenol is an extremely weak basic (essentially neutral) compound (based on its pKa). Cycloartenol is expected to be in Cannabis as all living plants are known to produce and metabolize it. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 9,19-Cyclo-9beta-lanost-24-en-3beta-ol | HMDB | | 9,19-Cycloart-24-ene, 3beta-ol | HMDB | | 9beta,19-Cyclo-24-lanosten-3beta-ol | HMDB | | 9beta,19-Cyclolanost-24-en-3beta-ol | HMDB | | Artosenol | HMDB | | Handianol | HMDB | | Cycloarterenol | MeSH | | Cycloartenol | MeSH |
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| Chemical Formula | C30H50O |
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| Average Molecular Weight | 426.72 |
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| Monoisotopic Molecular Weight | 426.3862 |
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| IUPAC Name | 7,7,12,16-tetramethyl-15-(6-methylhept-5-en-2-yl)pentacyclo[9.7.0.0^{1,3}.0^{3,8}.0^{12,16}]octadecan-6-ol |
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| Traditional Name | 7,7,12,16-tetramethyl-15-(6-methylhept-5-en-2-yl)pentacyclo[9.7.0.0^{1,3}.0^{3,8}.0^{12,16}]octadecan-6-ol |
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| CAS Registry Number | 469-38-5 |
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| SMILES | CC(CCC=C(C)C)C1CCC2(C)C3CCC4C5(CC35CCC12C)CCC(O)C4(C)C |
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| InChI Identifier | InChI=1S/C30H50O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h9,21-25,31H,8,10-19H2,1-7H3 |
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| InChI Key | ONQRKEUAIJMULO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as cycloartanols and derivatives. These are steroids containing a cycloartanol moiety. |
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| Kingdom | Organic compounds |
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| Super Class | Lipids and lipid-like molecules |
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| Class | Steroids and steroid derivatives |
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| Sub Class | Cycloartanols and derivatives |
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| Direct Parent | Cycloartanols and derivatives |
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| Alternative Parents | |
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| Substituents | - Cycloartanol-skeleton
- Triterpenoid
- Cycloartane-skeleton
- 9b,19-cyclo-lanostane-skeleton
- Hydroxysteroid
- 3-hydroxysteroid
- Cyclic alcohol
- Secondary alcohol
- Organic oxygen compound
- Hydrocarbon derivative
- Organooxygen compound
- Alcohol
- Aliphatic homopolycyclic compound
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| Molecular Framework | Aliphatic homopolycyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Disposition | Route of exposure: Biological location: Source: |
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| Role | Industrial application: Biological role: |
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | 99 °C | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | logP | Not Available | Not Available |
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| Predicted Properties | [] |
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| EI-MS/GC-MS | | Type | Description | Splash Key | View |
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| Predicted GC-MS | Cycloartenol, non-derivatized, Predicted GC-MS Spectrum - 70eV, Positive | splash10-03di-3129500000-84dc7a934204a370748a | Spectrum | | Predicted GC-MS | Cycloartenol, 1 TMS, Predicted GC-MS Spectrum - 70eV, Positive | splash10-00lr-4011900000-88cf4a746167f7db19cb | Spectrum |
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