CHEBI:166666 - Methyl geranate

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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 Methyl geranate
ChEBI ID CHEBI:166666
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H18O2
Net Charge 0
Average Mass 182.263
Monoisotopic Mass 182.13068
InChI InChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6,8H,5,7H2,1-4H3/b10-8+
InChIKey ACOBBFVLNKYODD-CSKARUKUSA-N
SMILES O(C(=O)\C=C(\CCC=C(C)C)/C)C
ChEBI Ontology
Outgoing Methyl geranate (CHEBI:166666) is a monoterpenoid (CHEBI:25409)
IUPAC Name
methyl (2E)-3,7-dimethylocta-2,6-dienoate
Manual Xrefs Databases
4517852 ChemSpider
HMDB0059816 HMDB
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Registry Number Type Source
1189-09-9 CAS Registry Number ChemIDplus