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CHEBI:119043 - 2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(4-methylphenyl)sulfonylamino]-2-oxanyl]acetic acid

ChEBI IDCHEBI:119043
ChEBI Name2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(4-methylphenyl)sulfonylamino]-2-oxanyl]acetic acid
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FormulaC15H21NO6S
Net Charge0
Average Mass343.401
Monoisotopic Mass343.10896
SMILESCc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)O)O[C@@H]2CO)cc1
InChIInChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13-,14+/m0/s1
InChIKeyBRLNHSCHDPURAU-FPMFFAJLSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(4-methylphenyl)sulfonylamino]-2-oxanyl]acetic acid (CHEBI:119043) is a C-glycosyl compound (CHEBI:20857)
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