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

ChEBI IDCHEBI:197218
ChEBI Name7-beta-Hydroxy-delta-9-THC
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30O3
Net Charge0
Average Mass330.468
Monoisotopic Mass330.21949
SMILESCCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)C[C@@H]1O
InChIInChI=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
InChIKeyDJCKLUPKZRLTPE-CMVHYPBASA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
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
Manual XrefsDatabases
HMDB0060909HMDB
35031814ChemSpider