CHEBI:227202 - Butyl homononactate

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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 Butyl homononactate
ChEBI ID CHEBI:227202
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H28O4
Net Charge 0
Average Mass 272.385
Monoisotopic Mass 272.19876
InChI InChI=1S/C15H28O4/c1-4-6-9-18-15(17)11(3)14-8-7-13(19-14)10-12(16)5-2/h11-14,16H,4-10H2,1-3H3/t11-,12+,13+,14-/m1/s1
InChIKey ZFKDLZOPYLJGOP-ZOBORPQBSA-N
SMILES O=C(OCCCC)[C@@H]([C@@H]1O[C@H](C[C@@H](O)CC)CC1)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: DOI
ChEBI Ontology
Outgoing Butyl homononactate (CHEBI:227202) is a oxolanes (CHEBI:26912)
IUPAC Name
butyl (2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoate
Manual Xref Database
40256804 ChemSpider
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