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CHEBI:213126 - Tsugicoline B

ChEBI IDCHEBI:213126
ChEBI NameTsugicoline B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC1(C)C[C@H]2[C@H](O)C(CO)=C3C(=O)C[C@]3(C)[C@H]2C1
InChIInChI=1S/C15H22O3/c1-14(2)4-8-10(5-14)15(3)6-11(17)12(15)9(7-16)13(8)18/h8,10,13,16,18H,4-7H2,1-3H3/t8-,10+,13+,15-/m1/s1
InChIKeyVDVUBXWVLRLNLQ-XGUWZRRLSA-N
Species of MetaboliteComponentSourceComments
Laurilia (ncbitaxon:154743) - DOI (10.1016/0040-4020(95)00848-3)
ChEBI Ontology
Outgoing Relation(s)
Tsugicoline B (CHEBI:213126) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4S,4aR,7aS,7bR)-4-hydroxy-3-(hydroxymethyl)-6,6,7b-trimethyl-1,4,4a,5,7,7a-hexahydrocyclobuta[e]inden-2-one
Manual XrefsDatabases
27445030ChemSpider