CHEBI:218946 - Flammulinolide C

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Flammulinolide C
ChEBI ID CHEBI:218946
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H18O4
Net Charge 0
Average Mass 250.294
Monoisotopic Mass 250.12051
InChI InChI=1S/C14H18O4/c1-7-4-8-5-13(2,3)12(16)14(8,17)10-9(7)6-18-11(10)15/h7-8,17H,4-6H2,1-3H3/t7-,8-,14-/m1/s1
InChIKey MABAJDZRQISYRJ-WFEFGEHDSA-N
SMILES O=C1OCC2=C1[C@@]3(O)C(=O)C(C)(C)C[C@H]3C[C@H]2C
Metabolite of Species Details
Flammulina velutipes (NCBI:txid38945) See: DOI
ChEBI Ontology
Outgoing Flammulinolide C (CHEBI:218946) is a butenolide (CHEBI:50523)
IUPAC Name
(4R,5aR,8aR)-8a-hydroxy-4,7,7-trimethyl-4,5,5a,6-tetrahydro-3H-cyclopenta[g][2]benzouran-1,8-dione
Manual Xref Database
78437614 ChemSpider
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