CHEBI:52442 - 1D-myo-inositol 2-acetamido-2-deoxy-α-D-glucopyranoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1D-myo-inositol 2-acetamido-2-deoxy-α-D-glucopyranoside
ChEBI ID CHEBI:52442
ChEBI ASCII Name 1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C14H25NO11
Net Charge 0
Average Mass 383.34840
Monoisotopic Mass 383.14276
InChI InChI=1S/C14H25NO11/c1-3(17)15-5-7(19)6(18)4(2-16)25-14(5)26-13-11(23)9(21)8(20)10(22)12(13)24/h4-14,16,18-24H,2H2,1H3,(H,15,17)/t4-,5-,6-,7-,8-,9-,10+,11-,12-,13-,14-/m1/s1
InChIKey MRKTUVZZZRUSQR-JPUVNKLSSA-N
SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
ChEBI Ontology
Outgoing 1D-myo-inositol 2-acetamido-2-deoxy-α-D-glucopyranoside (CHEBI:52442) has functional parent myo-inositol (CHEBI:17268)
1D-myo-inositol 2-acetamido-2-deoxy-α-D-glucopyranoside (CHEBI:52442) is a 2-deoxy-α-D-glucoside (CHEBI:37449)
IUPAC Name
1-O-(2-acetamido-2-deoxy-α-D-glucopyranosyl)-1D-myo-inositol
Synonyms Sources
1D-myo-inositol 2-acetamido-2-deoxy-α-D-glucopyranoside UniProt
GlcNAc-(α1,1)-1D-Ins SUBMITTER
GlcNac-Ins SUBMITTER
Last Modified
13 August 2014