Structure Database (LMSD)
Common Name
2-Deoxyribonic acid
Systematic Name
(3S,4R)-3,4,5-trihydroxypentanoic acid
Synonyms
3D model of 2-Deoxyribonic 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)
VBUWJOHKCBQXNU-IUYQGCFVSA-N
InChi (Click to copy)
InChI=1S/C5H10O5/c6-2-4(8)3(7)1-5(9)10/h3-4,6-8H,1-2H2,(H,9,10)/t3-,4+/m0/s1
SMILES (Click to copy)
O[C@@H](CC(=O)O)[C@H](O)CO
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
10
Rings
0
Aromatic Rings
0
Rotatable Bonds
4
Van der Waals Molecular Volume
136.37
Topological Polar Surface Area
97.99
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
5
logP
-0.97
Molar Refractivity
32.87
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Created at
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Updated at
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