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CHEBI:188849 - (+)-Boronolide

Default Structure
ChEBI IDCHEBI:188849
ChEBI Name(+)-Boronolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H26O8
Net Charge0
Average Mass370.398
Monoisotopic Mass370.16277
SMILES[H][C@@]1([C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](CCCC)OC(C)=O)CC=CC(=O)O1
InChIInChI=1S/C18H26O8/c1-5-6-8-14(23-11(2)19)17(24-12(3)20)18(25-13(4)21)15-9-7-10-16(22)26-15/h7,10,14-15,17-18H,5-6,8-9H2,1-4H3/t14-,15-,17-,18+/m0/s1
InChIKeyBRBSZFBUFZWHCT-UOVPBQLFSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(+)-Boronolide (CHEBI:188849) is a carboxylic acid (CHEBI:33575)
IUPAC Name 
[(1R,2S,3S)-1,2-diacetyloxy-1-[(2S)-6-oxo-2,3-dihydropyran-2-yl]heptan-3-yl] acetate