CHEBI:198899 - Cancrolide B

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ChEBI Name Cancrolide B
ChEBI ID CHEBI:198899
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H16O3
Net Charge 0
Average Mass 196.246
Monoisotopic Mass 196.10994
InChI InChI=1S/C11H16O3/c1-3-4-5-9-7-14-11(13)10(9)6-8(2)12/h3-4,8,12H,5-7H2,1-2H3/t8-/m0/s1
InChIKey PWZHEFFAUWAEMU-QMMMGPOBSA-N
SMILES O=C1OCC(=C1C[C@@H](O)C)CC=CC
Metabolite of Species Details
Chaetomium cancroideum (NCBI:txid874300) See: PubMed
ChEBI Ontology
Outgoing Cancrolide B (CHEBI:198899) is a butenolide (CHEBI:50523)
IUPAC Name
3-but-2-enyl-4-[(2S)-2-hydroxypropyl]-2H-uran-5-one