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CHEBI:224686 - Trichocadinin E

ChEBI IDCHEBI:224686
ChEBI NameTrichocadinin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESC=C1CC[C@@H](C(C)C)[C@H]2C=C(C(=O)O)C[C@@H](O)[C@@H]12
InChIInChI=1S/C15H22O3/c1-8(2)11-5-4-9(3)14-12(11)6-10(15(17)18)7-13(14)16/h6,8,11-14,16H,3-5,7H2,1-2H3,(H,17,18)/t11-,12+,13+,14-/m0/s1
InChIKeyBRZGUFNKBGZBHW-DGAVXFQQSA-N
Species of MetaboliteComponentSourceComments
Trichoderma (ncbitaxon:5543) - PubMed (31418264)
ChEBI Ontology
Outgoing Relation(s)
Trichocadinin E (CHEBI:224686) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4R,4aR,8S,8aS)-4-hydroxy-5-methylidene-8-propan-2-yl-4,4a,6,7,8,8a-hexahydro-3H-naphthalene-2-carboxylic acid