CHEBI:77273 - 11-nor-9-carboxy-Δ9-tetrahydrocannabinol

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ChEBI Name 11-nor-9-carboxy-Δ9-tetrahydrocannabinol
ChEBI ID CHEBI:77273
ChEBI ASCII Name 11-nor-9-carboxy-Delta(9)-tetrahydrocannabinol
Definition A phytocannabinoid that is Δ9-tetrahydrocannabinol in which the C-11 methyl has been fully oxidised to a carboxy group. Further enzymatic oxidation product of 11-hydroxy-Δ9-tetrahydrocannabinol.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C21H28O4
Net Charge 0
Average Mass 344.44460
Monoisotopic Mass 344.19876
InChI InChI=1S/C21H28O4/c1-4-5-6-7-13-10-17(22)19-15-12-14(20(23)24)8-9-16(15)21(2,3)25-18(19)11-13/h10-12,15-16,22H,4-9H2,1-3H3,(H,23,24)/t15-,16-/m1/s1
InChIKey YOVRGSHRZRJTLZ-HZPDHXFCSA-N
SMILES CCCCCc1cc(O)c2[C@@H]3C=C(CC[C@H]3C(C)(C)Oc2c1)C(O)=O
Roles Classification
Biological Role(s): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via phytocannabinoid )
cannabinoid receptor agonist
An agonist that binds to and activates cannabinoid receptors.
(via cannabinoid )
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ChEBI Ontology
Outgoing 11-nor-9-carboxy-Δ9-tetrahydrocannabinol (CHEBI:77273) has functional parent Δ9-tetrahydrocannabinol (CHEBI:66964)
11-nor-9-carboxy-Δ9-tetrahydrocannabinol (CHEBI:77273) has role human xenobiotic metabolite (CHEBI:76967)
11-nor-9-carboxy-Δ9-tetrahydrocannabinol (CHEBI:77273) is a phytocannabinoid (CHEBI:67196)
IUPAC Name
(6aR,10aR)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromene-9-carboxylic acid
Synonyms Sources
(6aR,10aR)-6a,7,8,10a-tetrahydro-1-hydroxy-6,6-dimethyl-3-pentyl-6H-dibenzo[b,d]pyran-9-carboxylic acid ChEBI
11-COOH-THC ChEBI
11-nor-9-carboxy-delta-9-tetrahydrocannabinol ChEBI
11-nor-9-carboxy-THC ChEBI
THC-11-oic acid ChEBI
THC-COOH ChEBI
Manual Xref Database
11-nor-9-Carboxy-THC Wikipedia
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Registry Numbers Types Sources
56354-06-4 CAS Registry Number ChemIDplus
6374032 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
1324293 PubMed citation Europe PMC
20630472 PubMed citation Europe PMC
21871147 PubMed citation Europe PMC
24185550 PubMed citation Europe PMC
28171147 PubMed citation Europe PMC
Last Modified
07 February 2014