Structure Database (LMSD)
Common Name
diamino-pimelic acid
Systematic Name
2,6-diamino-heptanedioic acid
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of diamino-pimelic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
GMKMEZVLHJARHF-WHFBIAKZSA-N
InChi (Click to copy)
InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1
SMILES (Click to copy)
C(=O)(O)[C@@H](N)CCC[C@H](N)C(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
13
Rings
0
Aromatic Rings
0
Rotatable Bonds
6
Van der Waals Molecular Volume
181.54
Topological Polar Surface Area
126.64
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
4
logP
-0.45
Molar Refractivity
46.10
Admin
Created at
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Updated at
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