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CHEBI:225429 - Mabetaarilactone B

ChEBI IDCHEBI:225429
ChEBI NameMabetaarilactone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O5
Net Charge0
Average Mass226.228
Monoisotopic Mass226.08412
SMILESC/C=C/[C@@H]1OC2=C(C(=O)O[C@H]2C)[C@H](O)[C@H]1O
InChIInChI=1S/C11H14O5/c1-3-4-6-8(12)9(13)7-10(16-6)5(2)15-11(7)14/h3-6,8-9,12-13H,1-2H3/b4-3+/t5-,6-,8-,9-/m0/s1
InChIKeyDXUWKSUWEMSKDA-MHLXCEJISA-N
Species of MetaboliteComponentSourceComments
Massarina (ncbitaxon:45292) - DOI (10.1016/s0040-4039(00)02160-2)
ChEBI Ontology
Outgoing Relation(s)
Mabetaarilactone B (CHEBI:225429) is a butenolide (CHEBI:50523)
IUPAC Name 
(2S,3R,4S,7S)-3,4-dihydroxy-7-methyl-2-[(E)-prop-1-enyl]-2,3,4,7-tetrahydrouro[3,4-b]pyran-5-one
Manual XrefsDatabases
8280624ChemSpider