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CHEBI:198378 - Rubetaulactarorufin

ChEBI IDCHEBI:198378
ChEBI NameRubetaulactarorufin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O6
Net Charge0
Average Mass296.319
Monoisotopic Mass296.12599
SMILESC[C@@]1(C(=O)O)C[C@H]2[C@@H](C1)[C@](C)(O)CC1=C(COC1=O)[C@@H]2O
InChIInChI=1S/C15H20O6/c1-14(13(18)19)3-8-10(5-14)15(2,20)4-7-9(11(8)16)6-21-12(7)17/h8,10-11,16,20H,3-6H2,1-2H3,(H,18,19)/t8-,10+,11+,14+,15+/m0/s1
InChIKeyGFPGDGFOFRPCIM-SAPLOEGBSA-N
Species of MetaboliteComponentSourceComments
Russula brevipes (ncbitaxon:98861) - DOI (10.1016/s0031-9422(97)00121-0)
ChEBI Ontology
Outgoing Relation(s)
Rubetaulactarorufin (CHEBI:198378) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(5R,5aR,7R,8aS,9R)-5,9-dihydroxy-5,7-dimethyl-3-oxo-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]uran-7-carboxylic acid
Manual XrefsDatabases
78440008ChemSpider