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CHEBI:215076 - Tsugicoline D

ChEBI IDCHEBI:215076
ChEBI NameTsugicoline D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILESCC1(C)C[C@H]2C=C(C=O)[C@@H]3C(=O)[C@@H](O)[C@]3(C)[C@H]2C1
InChIInChI=1S/C15H20O3/c1-14(2)5-8-4-9(7-16)11-12(17)13(18)15(11,3)10(8)6-14/h4,7-8,10-11,13,18H,5-6H2,1-3H3/t8-,10+,11-,13-,15-/m1/s1
InChIKeyLBCMHKJZRUVMJR-ICGCPXGVSA-N
Species of MetaboliteComponentSourceComments
Laurilia (ncbitaxon:154743) - DOI (10.1016/0040-4020(95)00848-3)
ChEBI Ontology
Outgoing Relation(s)
Tsugicoline D (CHEBI:215076) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,2aR,4aS,7aS,7bR)-1-hydroxy-6,6,7b-trimethyl-2-oxo-1,2a,4a,5,7,7a-hexahydrocyclobuta[e]indene-3-carbaldehyde
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27445033ChemSpider