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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > (2s)-2-amino-3-[[5-(2-aminoethyl)-2,3-dihydroxyphenyl]thio]propanoic acid
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > (2s)-2-amino-3-[[5-(2-aminoethyl)-2,3-dihydroxyphenyl]thio]propanoic acid
organic aromatic compound > phenols > (2s)-2-amino-3-[[5-(2-aminoethyl)-2,3-dihydroxyphenyl]thio]propanoic acid

Preferred term

(2s)-2-amino-3-[[5-(2-aminoethyl)-2,3-dihydroxyphenyl]thio]propanoic acid  

Type

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

charge

  • 0

formula

  • C11H16N2O4S

inchi

  • InChI=1S/C11H16N2O4S/c12-2-1-6-3-8(14)10(15)9(4-6)18-5-7(13)11(16)17/h3-4,7,14-15H,1-2,5,12-13H2,(H,16,17)/t7-/m1/s1

inchikey

  • BZYHBWCVRKSWDB-SSDOTTSWSA-N

mass

  • 272.322

monoisotopicmass

  • 272.08308

smiles

  • C1=C(C=C(C(=C1O)O)SC[C@H](C(=O)O)N)CCN

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:125550

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