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CHEBI:116602 - 2-[[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-furanyl]-oxomethyl]amino]pentanedioic acid dimethyl ester

ChEBI IDCHEBI:116602
ChEBI Name2-[[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-furanyl]-oxomethyl]amino]pentanedioic acid dimethyl ester
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FormulaC21H23NO8
Net Charge0
Average Mass417.414
Monoisotopic Mass417.14237
SMILESCOC(=O)CCC(NC(=O)c1cc(-c2ccc3c(c2)OCCO3)oc1C)C(=O)OC
InChIInChI=1S/C21H23NO8/c1-12-14(20(24)22-15(21(25)27-3)5-7-19(23)26-2)11-17(30-12)13-4-6-16-18(10-13)29-9-8-28-16/h4,6,10-11,15H,5,7-9H2,1-3H3,(H,22,24)
InChIKeyXSKYFPLGUZZMGD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-furanyl]-oxomethyl]amino]pentanedioic acid dimethyl ester (CHEBI:116602) is a glutamic acid derivative (CHEBI:24315)
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