GXS

(4R)-4-hydroxy-2,5-dioxopentanoic acid

Created:	2014-01-16
Last modified:	2024-09-27

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1 entries where GXS is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	1
Bond Count	15
Aromatic Bond Count	0

2D diagram of GXS

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Chemical Component Summary
Name	(4R)-4-hydroxy-2,5-dioxopentanoic acid
Systematic Name (OpenEye OEToolkits)	(4R)-4-oxidanyl-2,5-bis(oxidanylidene)pentanoic acid
Formula	C₅ H₆ O₅
Molecular Weight	146.098
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=CC(O)CC(=O)C(=O)O
SMILES	CACTVS	3.385	O[CH](CC(=O)C(O)=O)C=O
SMILES	OpenEye OEToolkits	1.7.6	C(C(C=O)O)C(=O)C(=O)O
Canonical SMILES	CACTVS	3.385	O[C@H](CC(=O)C(O)=O)C=O
Canonical SMILES	OpenEye OEToolkits	1.7.6	C([C@H](C=O)O)C(=O)C(=O)O
InChI	InChI	1.03	InChI=1S/C5H6O5/c6-2-3(7)1-4(8)5(9)10/h2-3,7H,1H2,(H,9,10)/t3-/m1/s1
InChIKey	InChI	1.03	QZKCWTOLHHFWCD-GSVOUGTGSA-N

Related Resource References

Resource Name	Reference
PubChem	118534805

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