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CHEBI:228920 - (-)-2beta-Hydroxykolavelool

ChEBI IDCHEBI:228920
ChEBI Name(-)-2beta-Hydroxykolavelool
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H34O2
Net Charge0
Average Mass306.490
Monoisotopic Mass306.25588
SMILES[H][C@]12C[C@H](O)C=C(C)[C@]1(C)CC[C@@H](C)[C@]2(C)CC[C@@](C)(O)C=C
InChIInChI=1S/C20H34O2/c1-7-18(4,22)10-11-20(6)14(2)8-9-19(5)15(3)12-16(21)13-17(19)20/h7,12,14,16-17,21-22H,1,8-11,13H2,2-6H3/t14-,16-,17+,18+,19+,20+/m1/s1
InChIKeyYBIQUOCNAHKKPT-QIXFSGBHSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
(-)-2beta-Hydroxykolavelool (CHEBI:228920) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(2S,4aR,7R,8S,8aR)-8-[(3R)-3-hydroxy-3-methylpent-4-enyl]-4,4a,7,8-tetramethyl-1,2,5,6,7,8a-hexahydronaphthalen-2-ol
Manual XrefsDatabases
4476852ChemSpider