Structure Database (LMSD)
Common Name
S-(2-Methylpropionyl)-dihydrolipoamide-E
Systematic Name
8-[(2-methylpropanoyl)sulfanyl]-6-sulfanyloctanamide
Synonyms
3D model of S-(2-Methylpropionyl)-dihydrolipoamide-E
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
String Representations
InChiKey (Click to copy)
UEFURMXXHJCLJP-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C12H23NO2S2/c1-9(2)12(15)17-8-7-10(16)5-3-4-6-11(13)14/h9-10,16H,3-8H2,1-2H3,(H2,13,14)
SMILES (Click to copy)
C(CCCC(CCSC(C(C)C)=O)S)C(N)=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
17
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
276.48
Topological Polar Surface Area
60.16
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
3.21
Molar Refractivity
78.36
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Created at
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Updated at
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