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CHEBI:206304 - Nigriterpene D

ChEBI IDCHEBI:206304
ChEBI NameNigriterpene D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O2
Net Charge0
Average Mass232.323
Monoisotopic Mass232.14633
SMILESC=C(CO)C1=C[C@@]2(C)C(=CC1=O)CCC[C@@H]2C
InChIInChI=1S/C15H20O2/c1-10(9-16)13-8-15(3)11(2)5-4-6-12(15)7-14(13)17/h7-8,11,16H,1,4-6,9H2,2-3H3/t11-,15+/m0/s1
InChIKeySAMVWKCQIGXERU-XHDPSFHLSA-N
Species of MetaboliteComponentSourceComments
Xylaria nigripes (ncbitaxon:490159) - PubMed (28055210)
ChEBI Ontology
Outgoing Relation(s)
Nigriterpene D (CHEBI:206304) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4aS,5S)-3-(3-hydroxyprop-1-en-2-yl)-4a,5-dimethyl-5,6,7,8-tetrahydronaphthalen-2-one
Manual XrefsDatabases
76788802ChemSpider