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CHEBI:59653 - arseno-mycothiol(1−)

ChEBI IDCHEBI:59653
ChEBI Namearseno-mycothiol(1−)
Stars
ASCII Namearseno-mycothiol(1-)
DefinitionThe anion resulting from the removal of a proton from the arsenate group of arseno-mycothiol.
Last Modified21 June 2010
SubmitterGareth Owen
DownloadsMolfile
FormulaC17H30AsN2O15S
Net Charge-1
Average Mass609.415
Monoisotopic Mass609.05883
SMILESCC(=O)N[C@@H](CS[As](=O)([O-])O)C(=O)N[C@H]1[C@@H](O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C17H31AsN2O15S/c1-4(22)19-5(3-36-18(31,32)33)16(30)20-7-9(24)8(23)6(2-21)34-17(7)35-15-13(28)11(26)10(25)12(27)14(15)29/h5-15,17,21,23-29H,2-3H2,1H3,(H,19,22)(H,20,30)(H2,31,32,33)/p-1/t5-,6+,7+,8+,9+,10-,11-,12+,13+,14+,15-,17+/m0/s1
InChIKeyUFFVRAZTLALLGR-FQBKTPCVSA-M
ChEBI Ontology
Outgoing Relation(s)
arseno-mycothiol(1−) (CHEBI:59653) is a organic anion (CHEBI:25696)
arseno-mycothiol(1−) (CHEBI:59653) is conjugate acid of arseno-mycothiol(2−) (CHEBI:59655)
arseno-mycothiol(1−) (CHEBI:59653) is conjugate base of arseno-mycothiol (CHEBI:59651)
Incoming Relation(s)
arseno-mycothiol (CHEBI:59651) is conjugate acid of arseno-mycothiol(1−) (CHEBI:59653)
arseno-mycothiol(2−) (CHEBI:59655) is conjugate base of arseno-mycothiol(1−) (CHEBI:59653)
IUPAC Name 
(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-{[N-acetyl-S-(hydroxyarsinato)-L-cysteinyl]amino}-2-deoxy-α-D-glucopyranoside
Synonym  Source
arsenomycothiol(1−)ChEBI