| Record Information |
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| Version | 1.0 |
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| Created at | 2020-03-19 00:54:46 UTC |
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| Updated at | 2020-11-18 16:35:29 UTC |
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| CannabisDB ID | CDB000750 |
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| Secondary Accession Numbers | Not Available |
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| Cannabis Compound Identification |
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| Common Name | 4-Hydroxy-2,3,6,7-tetramethoxy-9,10-dihydrophenanthrene |
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| Description | 4-Hydroxy-2,3,6,7-tetramethoxy-9,10-dihydrophenanthrene belongs to the class of organic compounds known as hydrophenanthrenes. These are phenanthrene derivatives where at least one ring carbon-carbon double bond has been reduced via hydrogenation. Phenanthrenes are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzenes. 4-Hydroxy-2,3,6,7-tetramethoxy-9,10-dihydrophenanthrene is also classified as a phenanthrenoid. Phenanthrenoids are chemical compounds formed with a phenanthrene backbone. 4-Hydroxy-2,3,6,7-tetramethoxy-9,10-dihydrophenanthrene is a hydrophobic, neutral molecule that is insoluble in water. 4-hydroxy-2,3,6,7-tetramethoxy-9,10-dihydrophenanthren is a derivative of 9,10-dihydrophenanthrene. 9,10-dihydrophenanthrens have been isolated from Cannabis sativa ( Ref:DOI ). Hydrophenanthrenes in Cannabis are structurally derived from stilbenoids, which have undergone an additional cyclization reaction to yield the phenanthrene skeleton. |
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| Structure | |
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| Synonyms | Not Available |
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| Chemical Formula | C18H20O5 |
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| Average Molecular Weight | 316.35 |
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| Monoisotopic Molecular Weight | 316.1311 |
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| IUPAC Name | 2,3,6,7-tetramethoxy-9,10-dihydrophenanthren-4-ol |
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| Traditional Name | 2,3,6,7-tetramethoxy-9,10-dihydrophenanthren-4-ol |
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| CAS Registry Number | Not Available |
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| SMILES | COC1=CC2=C(C(O)=C1OC)C1=CC(OC)=C(OC)C=C1CC2 |
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| InChI Identifier | InChI=1S/C18H20O5/c1-20-13-7-10-5-6-11-8-15(22-3)18(23-4)17(19)16(11)12(10)9-14(13)21-2/h7-9,19H,5-6H2,1-4H3 |
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| InChI Key | WINFXCCVLVWQDW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as hydrophenanthrenes. These are a phenanthrene derivative where at least one ring CC bond is substituted by hydrogenation. |
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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 | Hydrophenanthrenes |
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| Direct Parent | Hydrophenanthrenes |
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| Alternative Parents | |
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| Substituents | - Hydrophenanthrene
- 1-naphthol
- Naphthalene
- Phenol ether
- Anisole
- 1-hydroxy-4-unsubstituted benzenoid
- Phenol
- Alkyl aryl ether
- Ether
- Organic oxygen compound
- Hydrocarbon derivative
- Organooxygen compound
- Aromatic homopolycyclic compound
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| Molecular Framework | Aromatic homopolycyclic compounds |
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| External Descriptors | Not Available |
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| Ontology |
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|
Not Available | | Physical Properties |
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| State | Solid |
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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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