7-beta-Hydroxy-delta-9-THC (CHEBI:197218)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	7-beta-Hydroxy-delta-9-THC

ChEBI ID	CHEBI:197218

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H30O3

Net Charge

Average Mass

330.468

Monoisotopic Mass

330.21949

InChI

InChI=1S/C21H30O3/c1-5-6-7-8-14-11-16(22)19-15-9-13(2)10-17(23)20(15)21(3,4)24-18(19)12-14/h9,11-12,15,17,20,22-23H,5-8,10H2,1-4H3/t15?,17-,20?/m0/s1

InChIKey

DJCKLUPKZRLTPE-CMVHYPBASA-N

SMILES

O1C(C2C(C=3C1=CC(=CC3O)CCCCC)C=C(C[C@@H]2O)C)(C)C

Metabolite of Species	Details
Cannabis sativa (NCBI:txid3483)	Found in inflorescence (BTO:0000628). of strain Cannabis sativa var. DMG265 See: MetaboLights Study

ChEBI Ontology
Outgoing	7-beta-Hydroxy-delta-9-THC (CHEBI:197218) is a 1-benzopyran (CHEBI:38443)

IUPAC Name

(7S)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-1,7-diol