Structure Database (LMSD)

Common Name
N-stearoyl glycine
Systematic Name
N-octadecanoyl-glycine
Synonyms
  • EMA-1
  • Elmiric acid
LM ID
LMFA08020077
Formula
Exact Mass
Calculate m/z
341.292994
Sum Composition
Status
Active

Classification

String Representations

InChiKey (Click to copy)
UEYROBDNFIWNST-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C20H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24/h2-18H2,1H3,(H,21,22)(H,23,24)
SMILES (Click to copy)
C(CNC(CCCCCCCCCCCCCCCCC)=O)(=O)O

Other Databases

HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 24
Rings 0
Aromatic Rings 0
Rotatable Bonds 18
Van der Waals Molecular Volume 386.65
Topological Polar Surface Area 66.40
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 5.73
Molar Refractivity 100.68

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Created at
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Updated at
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