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CHEBI:173423 - Cumanin

ChEBI IDCHEBI:173423
ChEBI NameCumanin
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FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESC=C1C(=O)OC2C[C@H](C)C3C[C@H](O)[C@H](O)[C@@]3(C)CC12
InChIInChI=1S/C15H22O4/c1-7-4-12-9(8(2)14(18)19-12)6-15(3)10(7)5-11(16)13(15)17/h7,9-13,16-17H,2,4-6H2,1,3H3/t7-,9?,10?,11-,12?,13-,15-/m0/s1
InChIKeyZFCRHGITKWEXDY-RKKSEIHCSA-N
ChEBI Ontology
Outgoing Relation(s)
Cumanin (CHEBI:173423) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name 
(5S,7S,8R,8aS)-7,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]uran-2-one
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