Structure Database (LMSD)
Common Name
N-(3-carboxypropanoyl)-N-hydroxycadaverine
Systematic Name
4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoic acid
Synonyms
- HSC
- N-hydroxy-N-succinylcadaverine
3D model of N-(3-carboxypropanoyl)-N-hydroxycadaverine
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)
VUXMGAKZQBQIAH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C9H18N2O4/c10-6-2-1-3-7-11(15)8(12)4-5-9(13)14/h15H,1-7,10H2,(H,13,14)
SMILES (Click to copy)
OC(CCC(=O)N(CCCCCN)O)=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
8
Van der Waals Molecular Volume
216.14
Topological Polar Surface Area
103.86
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
logP
0.94
Molar Refractivity
54.12
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Updated at
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