GYV

2-acetamido-1-O-carbamoyl-2-deoxy-alpha-D-glucopyranose

Created:2010-01-26
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count34
Chiral Atom Count5
Bond Count34
Aromatic Bond Count0
2D diagram of GYV

Chemical Component Summary

Name2-acetamido-1-O-carbamoyl-2-deoxy-alpha-D-glucopyranose
Synonyms2-(ACETYLAMINO)-1-O-CARBAMOYL-2-DEOXY-ALPHA-D-GLUCOPYRANOSE; 2-acetamido-1-O-carbamoyl-2-deoxy-alpha-D-glucose; 2-acetamido-1-O-carbamoyl-2-deoxy-D-glucose; 2-acetamido-1-O-carbamoyl-2-deoxy-glucose
Systematic Name (OpenEye OEToolkits)[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] carbamate
FormulaC9 H16 N2 O7
Molecular Weight264.233
TypeD-SACCHARIDE

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(OC1OC(C(O)C(O)C1NC(=O)C)CO)N
SMILESCACTVS3.352CC(=O)N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1OC(N)=O
SMILESOpenEye OEToolkits1.6.1CC(=O)NC1C(C(C(OC1OC(=O)N)CO)O)O
Canonical SMILESCACTVS3.352 CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1OC(N)=O
Canonical SMILESOpenEye OEToolkits1.6.1 CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OC(=O)N)CO)O)O
InChIInChI1.03 InChI=1S/C9H16N2O7/c1-3(13)11-5-7(15)6(14)4(2-12)17-8(5)18-9(10)16/h4-8,12,14-15H,2H2,1H3,(H2,10,16)(H,11,13)/t4-,5-,6-,7-,8-/m1/s1
InChIKeyInChI1.03 BMFDLZBABRHLIB-FMDGEEDCSA-N

Related Resource References

Resource NameReference
PubChem 46174147