CHEBI:179916 - Senkyunolide

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ChEBI Name Senkyunolide
ChEBI ID CHEBI:179916
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H16O2
Net Charge 0
Average Mass 192.258
Monoisotopic Mass 192.11503
InChI InChI=1S/C12H16O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7,11H,2-4,6,8H2,1H3/t11-/m0/s1
InChIKey ZPIKVDODKLJKIN-NSHDSACASA-N
SMILES O1[C@H](C=2CCC=CC2C1=O)CCCC
ChEBI Ontology
Outgoing Senkyunolide (CHEBI:179916) is a 2-benzofurans (CHEBI:38831)
IUPAC Name
(3S)-3-butyl-4,5-dihydro-3H-2-benzouran-1-one
Manual Xrefs Databases
2342201 ChemSpider
C17853 KEGG COMPOUND
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Registry Number Type Source
63038-10-8 CAS Registry Number ChemIDplus