Structure Database (LMSD)

Common Name
2,3-diamino-propionic acid
Systematic Name
2S,3-diamino-propionic acid
Synonyms
LM ID
LMFA01100051
Status
Active
Exact Mass
Calculate m/z
104.058578
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)
PECYZEOJVXMISF-REOHCLBHSA-N
InChi (Click to copy)
InChI=1S/C3H8N2O2/c4-1-2(5)3(6)7/h2H,1,4-5H2,(H,6,7)/t2-/m0/s1
SMILES (Click to copy)
C(=O)(O)[C@@H](N)CN

References

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 7
Rings 0
Aromatic Rings 0
Rotatable Bonds 2
Van der Waals Molecular Volume 97.40
Topological Polar Surface Area 89.34
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 2
logP -1.07
Molar Refractivity 25.67

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Created at
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Updated at
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