CHEBI:52285 - 1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranoside
ChEBI ID CHEBI:52285
ChEBI ASCII Name 1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-alpha-D-glucopyranoside
Definition A 2-deoxy-α-D-glucoside having an L-cysteinylamino group at the 2-position and an inosityl group attached at the 1-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H28N2O11S
Net Charge 0
Average Mass 444.450
Monoisotopic Mass 444.14138
InChI InChI=1S/C15H28N2O11S/c16-3(2-29)14(26)17-5-7(20)6(19)4(1-18)27-15(5)28-13-11(24)9(22)8(21)10(23)12(13)25/h3-13,15,18-25,29H,1-2,16H2,(H,17,26)/t3-,4+,5+,6+,7+,8-,9-,10+,11+,12+,13-,15+/m0/s1
InChIKey ZGXSCMBZZVXWGF-BSEFFJTHSA-N
SMILES C([C@H](CS)N)(N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O[C@@H]2[C@@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)O)O)O)CO)O)O)=O
ChEBI Ontology
Outgoing 1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranoside (CHEBI:52285) has functional parent myo-inositol (CHEBI:17268)
1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranoside (CHEBI:52285) is a 2-deoxy-α-D-glucoside (CHEBI:37449)
1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranoside (CHEBI:52285) is conjugate base of 1D-myo-inositol 2-(L-cysteiniumylamino)-2-deoxy-α-D-glucopyranoside (CHEBI:58887)
Incoming 1D-myo-inositol 2-(L-cysteiniumylamino)-2-deoxy-α-D-glucopyranoside (CHEBI:58887) is conjugate acid of 1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranoside (CHEBI:52285)
IUPAC Name
1-O-[2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranosyl]-1D-myo-inositol
Synonyms Sources
1-O-[2-(L-cysteinamido)-2-deoxy-α-D-glucopyranosyl]-1D-myo-inositol KEGG COMPOUND
1D-myo-inositol 2-(L-cysteinyl)amido-2-deoxy-α-D-glucopyranoside IUBMB
desacetylmycothiol KEGG COMPOUND
Manual Xrefs Databases
C19703 KEGG COMPOUND
MA8 PDBeChem
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Citation Waiting for Citations Type Source
16326705 PubMed citation Europe PMC
Last Modified
21 November 2019