| Record Information |
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| Version | 1.0 |
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| Created at | 2020-04-27 17:07:22 UTC |
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| Updated at | 2021-01-06 19:06:58 UTC |
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| CannabisDB ID | CDB005896 |
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| Secondary Accession Numbers | Not Available |
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| Cannabis Compound Identification |
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| Common Name | Benzo[ghi]fluoranthene |
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| Description | Benzo[ghi]fluoranthene, also known as 2,13-benzofluoranthene, belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene. Benzo[ghi]fluoranthene is formed during the combustion of cannabis and is therefore a constituent of cannabis smoke ( Ref:DOI ). |
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| Structure | |
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| Synonyms | | Value | Source |
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| 2,13-Benzofluoranthene | Kegg | | 7,10-Benzofluoranthene | MeSH | | Benzo(ghi)fluoranthene | MeSH | | Benzo(mno)fluoranthene | MeSH |
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| Chemical Formula | C18H10 |
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| Average Molecular Weight | 226.28 |
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| Monoisotopic Molecular Weight | 226.0783 |
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| IUPAC Name | pentacyclo[8.8.0.0^{2,7}.0^{3,17}.0^{13,18}]octadeca-1,3,5,7,9,11,13(18),14,16-nonaene |
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| Traditional Name | pentacyclo[8.8.0.0^{2,7}.0^{3,17}.0^{13,18}]octadeca-1,3,5,7,9,11,13(18),14,16-nonaene |
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| CAS Registry Number | 203-12-3 |
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| SMILES | C1=CC2=CC=C3C=CC4=C5C(=CC=C4)C(=C1)C2=C35 |
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| InChI Identifier | InChI=1S/C18H10/c1-3-11-7-9-13-10-8-12-4-2-6-15-14(5-1)16(11)18(13)17(12)15/h1-10H |
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| InChI Key | YEIHPPOCKIHUQJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene. |
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| Kingdom | Organic compounds |
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| Super Class | Benzenoids |
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| Class | Phenanthrenes and derivatives |
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| Sub Class | Not Available |
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| Direct Parent | Phenanthrenes and derivatives |
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| Alternative Parents | |
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| Substituents | - Phenanthrene
- Naphthalene
- Aromatic hydrocarbon
- Polycyclic hydrocarbon
- Unsaturated hydrocarbon
- Hydrocarbon
- Aromatic homopolycyclic compound
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| Molecular Framework | Aromatic homopolycyclic compounds |
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| External Descriptors | |
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| Ontology |
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Not Available | | Physical Properties |
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| State | Not Available |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | 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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