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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > dicarboxylic acid > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
organooxygen compound > carbon oxoacid > carboxylic acid > dicarboxylic acid > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > dicarboxylic acid > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
organic aromatic compound > phenols > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
... > organooxygen compound > carbonyl compound > carboxylic acid > amino acid > alpha-amino acid > non-proteinogenic alpha-amino acid > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
... > organooxygen compound > carbon oxoacid > carboxylic acid > amino acid > alpha-amino acid > non-proteinogenic alpha-amino acid > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
... > organooxygen compound > carbonyl compound > carboxylic acid > amino acid > non-proteinogenic amino acid > non-proteinogenic alpha-amino acid > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid
... > organooxygen compound > carbon oxoacid > carboxylic acid > amino acid > non-proteinogenic amino acid > non-proteinogenic alpha-amino acid > 7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid

Preferred term

7-(2-amino-2-carboxyethyl)-5-hydroxy-2h-1,4-benzothiazine-3-carboxylic acid  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C12H12N2O5S

inchi

  • InChI=1S/C12H12N2O5S/c13-6(11(16)17)1-5-2-8(15)10-9(3-5)20-4-7(14-10)12(18)19/h2-3,6,15H,1,4,13H2,(H,16,17)(H,18,19)

inchikey

  • MYILHSJZODALKH-UHFFFAOYSA-N

mass

  • 296.29900

monoisotopicmass

  • 296.04669

smiles

  • NC(Cc1cc(O)c2N=C(CSc2c1)C(O)=O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 7-(2-amino-2-carboxyethyl)-5-hydroxy-2H-1,4-benzothiazine-3-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:84301

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