CHEBI:199188 - (3R*,4S*,5S*)-3-Acetoxy-5-hydroxyhexan-4

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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 (3R*,4S*,5S*)-3-Acetoxy-5-hydroxyhexan-4
ChEBI ID CHEBI:199188
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H12O5
Net Charge 0
Average Mass 188.179
Monoisotopic Mass 188.06847
InChI InChI=1S/C8H12O5/c1-4(9)8-6(12-5(2)10)3-7(11)13-8/h4,6,8-9H,3H2,1-2H3/t4-,6+,8-/m0/s1
InChIKey DBLLZDYDAFRZEE-SJIRYBADSA-N
SMILES O=C1O[C@@H]([C@@H](O)C)[C@@H](C1)OC(=O)C
Metabolite of Species Details
Tapinella atrotomentosa (NCBI:txid72122) See: DOI
ChEBI Ontology
Outgoing (3R*,4S*,5S*)-3-Acetoxy-5-hydroxyhexan-4 (CHEBI:199188) is a γ-lactone (CHEBI:37581)
IUPAC Name
[(2S,3R)-2-[(1S)-1-hydroxyethyl]-5-oxooxolan-3-yl] acetate
Manual Xref Database
61639125 ChemSpider
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