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CHEBI:221647 - Botryosphaerilactone B

ChEBI IDCHEBI:221647
ChEBI NameBotryosphaerilactone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22O5
Net Charge0
Average Mass270.325
Monoisotopic Mass270.14672
SMILESCC(=O)[C@@H]1CO[C@H](OC[C@H]2[C@H](C)C(=O)O[C@@H]2C)[C@H]1C
InChIInChI=1S/C14H22O5/c1-7-12(10(4)19-13(7)16)6-18-14-8(2)11(5-17-14)9(3)15/h7-8,10-12,14H,5-6H2,1-4H3/t7-,8-,10+,11+,12-,14+/m0/s1
InChIKeyQBYSXXFQLGDNCX-DDQFFZQOSA-N
Species of MetaboliteComponentSourceComments
Botryosphaeria (ncbitaxon:45132) - DOI (10.1016/j.tet.2009.10.084)
ChEBI Ontology
Outgoing Relation(s)
Botryosphaerilactone B (CHEBI:221647) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(3S,4R,5R)-4-[[(2S,3S,4S)-4-acetyl-3-methyloxolan-2-yl]oxymethyl]-3,5-dimethyloxolan-2-one
Manual XrefsDatabases
78438226ChemSpider