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CHEBI:210912 - Harzianelactone A

ChEBI IDCHEBI:210912
ChEBI NameHarzianelactone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILESCC1=C2C(=O)OC[C@@]2(C)[C@@H]2C[C@@H]3C[C@H](O)[C@@H](C)[C@@]2(CC1)C3(C)C
InChIInChI=1S/C20H30O3/c1-11-6-7-20-12(2)14(21)8-13(18(20,3)4)9-15(20)19(5)10-23-17(22)16(11)19/h12-15,21H,6-10H2,1-5H3/t12-,13+,14+,15+,19+,20-/m1/s1
InChIKeyMZGOCRPRCLJRSV-XWZQZKPHSA-N
Species of MetaboliteComponentSourceComments
Trichoderma (ncbitaxon:5543) - PubMed (31527674)
ChEBI Ontology
Outgoing Relation(s)
Harzianelactone A (CHEBI:210912) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(1S,9S,10R,12R,14S,15S)-14-hydroxy-4,9,15,16,16-pentamethyl-7-oxatetracyclo[10.3.1.01,10.05,9]hexadec-4-en-6-one
Manual XrefsDatabases
78315777ChemSpider