CHEBI:80837 - Isoelemicin

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ChEBI Name Isoelemicin
ChEBI ID CHEBI:80837
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C12H16O3
Net Charge 0
Average Mass 208.25360
Monoisotopic Mass 208.10994
InChI InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5-8H,1-4H3/b6-5+
InChIKey RRXOQHQFJOQLQR-AATRIKPKSA-N
SMILES COc1cc(cc(OC)c1OC)\C=C\C
ChEBI Ontology
Outgoing Isoelemicin (CHEBI:80837) is a olefinic compound (CHEBI:78840)
Manual Xrefs Databases
C16975 KEGG COMPOUND
HMDB0029867 HMDB
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Registry Number Type Source
5273-85-8 CAS Registry Number KEGG COMPOUND