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CHEBI:199423 - Curvularin-7-O-beta-D-glucopyranoside

ChEBI IDCHEBI:199423
ChEBI NameCurvularin-7-O-beta-D-glucopyranoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H30O10
Net Charge0
Average Mass454.472
Monoisotopic Mass454.18390
SMILESC[C@H]1CCCCCC(=O)c2c(cc(O)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC(=O)O1
InChIInChI=1S/C22H30O10/c1-11-5-3-2-4-6-14(25)18-12(8-17(26)30-11)7-13(24)9-15(18)31-22-21(29)20(28)19(27)16(10-23)32-22/h7,9,11,16,19-24,27-29H,2-6,8,10H2,1H3/t11-,16+,19+,20-,21+,22+/m0/s1
InChIKeyZVZVCUJMXWWVOP-ZJSNUJCSSA-N
Species of MetaboliteComponentSourceComments
Pseudonocardia (ncbitaxon:1847) - PubMed (26119337)
ChEBI Ontology
Outgoing Relation(s)
Curvularin-7-O-beta-D-glucopyranoside (CHEBI:199423) is a glycoside (CHEBI:24400)
IUPAC Name 
(5S)-15-hydroxy-5-methyl-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-oxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-3,11-dione
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9801380ChemSpider