CHEBI:196274 - Falcarindiol 3-acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Falcarindiol 3-acetate
ChEBI ID CHEBI:196274
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H26O3
Net Charge 0
Average Mass 302.414
Monoisotopic Mass 302.18819
InChI InChI=1S/C19H26O3/c1-4-6-7-8-9-10-11-14-18(21)15-12-13-16-19(5-2)22-17(3)20/h5,11,14,18-19,21H,2,4,6-10H2,1,3H3/b14-11-/t18-,19+/m0/s1
InChIKey UZDRBZORBWOTCF-ANIPCXSSSA-N
SMILES O[C@@H](/C=C\CCCCCCC)C#CC#C[C@H](OC(=O)C)C=C
ChEBI Ontology
Outgoing Falcarindiol 3-acetate (CHEBI:196274) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(3R,8S,9Z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl] acetate
Manual Xref Database
103881677 ChemSpider
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