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CHEBI:105443 - 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester

ChEBI IDCHEBI:105443
ChEBI Name2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester
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DownloadsMolfile
FormulaC21H17NO6S
Net Charge0
Average Mass411.435
Monoisotopic Mass411.07766
SMILESCOc1ccc2c(COC(=O)CC3Sc4ccccc4NC3=O)cc(=O)oc2c1
InChIInChI=1S/C21H17NO6S/c1-26-13-6-7-14-12(8-20(24)28-16(14)9-13)11-27-19(23)10-18-21(25)22-15-4-2-3-5-17(15)29-18/h2-9,18H,10-11H2,1H3,(H,22,25)
InChIKeyANIJAGIIVRSADG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester (CHEBI:105443) is a coumarins (CHEBI:23403)
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LSM-16806LINCS