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CHEBI:199968 - (1R,6R,9S,10S)-9-chloro-10-hydroxy-8-methoxycarbonyl-4-methylene-2,5-dioxabicyclo[4.4.O]dec-3-one-7

ChEBI IDCHEBI:199968
ChEBI Name(1R,6R,9S,10S)-9-chloro-10-hydroxy-8-methoxycarbonyl-4-methylene-2,5-dioxabicyclo[4.4.O]dec-3-one-7
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H11ClO6
Net Charge0
Average Mass274.656
Monoisotopic Mass274.02442
SMILESC=C1O[C@@H]2C=C(C(=O)OC)[C@H](Cl)[C@@H](O)[C@H]2OC1=O
InChIInChI=1S/C11H11ClO6/c1-4-10(14)18-9-6(17-4)3-5(11(15)16-2)7(12)8(9)13/h3,6-9,13H,1H2,2H3/t6-,7+,8-,9+/m1/s1
InChIKeyVKRZBNIAQCJAJF-XAVMHZPKSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,6R,9S,10S)-9-chloro-10-hydroxy-8-methoxycarbonyl-4-methylene-2,5-dioxabicyclo[4.4.O]dec-3-one-7 (CHEBI:199968) is a dioxanes (CHEBI:46926)
IUPAC Name 
methyl (4aR,5S,6S,8aR)-6-chloro-5-hydroxy-2-methylidene-3-oxo-4a,5,6,8a-tetrahydro-1,4-benzodioxine-7-carboxylate
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