Structure Database (LMSD)

Common Name
2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid
Systematic Name
2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid
Synonyms
  • 2-Amino-3,7-dideoxy-D-threo-hept-6-ulosonic acid
LM ID
LMFA01050473
Status
Active
Exact Mass
Calculate m/z
191.079374
Formula


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
IFMHGOADXGYWMO-KVQBGUIXSA-N
InChi (Click to copy)
InChI=1S/C7H13NO5/c1-3(9)6(11)5(10)2-4(8)7(12)13/h4-6,10-11H,2,8H2,1H3,(H,12,13)/t4-,5+,6+/m0/s1
SMILES (Click to copy)
C([C@H](N)C(O)=O)[C@@H](O)[C@H](O)C(=O)C

References

Other Databases

KEGG ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 5
Van der Waals Molecular Volume 179.33
Topological Polar Surface Area 120.85
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 5
logP -1.04
Molar Refractivity 44.46

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Updated at
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