Structure Database (LMSD)

Common Name
Galactaric acid
Systematic Name
2R,3S,4R,5S-tetrahydroxy-hexanedioic acid
Synonyms
LM ID
LMFA01170107
Formula
Exact Mass
Calculate m/z
210.03757
Sum Composition
Status
Active


Classification

String Representations

InChiKey (Click to copy)
DSLZVSRJTYRBFB-DUHBMQHGSA-N
InChi (Click to copy)
InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2+,3+,4-
SMILES (Click to copy)
C(=O)(O)[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O

Other Databases

HMDB ID
CHEBI ID
PubChem CID
Cayman ID
PDB ID

Calculated Physicochemical Properties

Heavy Atoms 14
Rings 0
Aromatic Rings 0
Rotatable Bonds 5
Van der Waals Molecular Volume 177.40
Topological Polar Surface Area 155.52
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 8
logP -2.26
Molar Refractivity 41.35

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Created at
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Updated at
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