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CHEBI:232496 - toussaintine A

Default Structure
ChEBI IDCHEBI:232496
ChEBI Nametoussaintine A
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SubmitterFlyBase
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FormulaC17H15NO4
Net Charge0
Average Mass297.310
Monoisotopic Mass297.10011
SMILES[H]/C(C(=O)N1C(=O)C[C@@]2(O)C=CC(=O)C[C@]12[H])=C(/[H])c1ccccc1
InChIInChI=1S/C17H15NO4/c19-13-8-9-17(22)11-16(21)18(14(17)10-13)15(20)7-6-12-4-2-1-3-5-12/h1-9,14,22H,10-11H2/b7-6+/t14-,17-/m0/s1
InChIKeyQCYNQLVLOBLZFY-MFTLYIETSA-N
Species of MetaboliteComponentSourceComments
Toussaintia orientalis (ncbitaxon:489350) - PubMed (36410467)
ChEBI Ontology
Outgoing Relation(s)
toussaintine A (CHEBI:232496) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(3aR,7aS)-3a-hydroxy-1-[(E)-3-phenylprop-2-enoyl]-7,7a-dihydro-3H-indole-2,6-dione
Citations