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CHEBI:213805 - Tsugicoline M

ChEBI IDCHEBI:213805
ChEBI NameTsugicoline M
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O4
Net Charge0
Average Mass262.305
Monoisotopic Mass262.12051
SMILESCC1=C2CC(C)(C)C[C@H]2[C@H](O)c2coc(C(=O)O)c21
InChIInChI=1S/C15H18O4/c1-7-8-4-15(2,3)5-9(8)12(16)10-6-19-13(11(7)10)14(17)18/h6,9,12,16H,4-5H2,1-3H3,(H,17,18)/t9-,12+/m1/s1
InChIKeyDGPKQXFVKQMEKD-SKDRFNHKSA-N
Species of MetaboliteComponentSourceComments
Clavicorona (ncbitaxon:48020) - DOI (10.1016/s0040-4020(03)00738-5)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Tsugicoline M (CHEBI:213805) is a furoic acid (CHEBI:36055)
IUPAC Name 
(4S,4aR)-4-hydroxy-6,6,8-trimethyl-4,4a,5,7-tetrahydrocyclopenta[][2]benzouran-1-carboxylic acid
Manual XrefsDatabases
8440157ChemSpider