S2G

(2S)-2-HYDROXYPENTANEDIOIC ACID

Created:	2011-03-10
Last modified:	2011-06-04

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6 entries where S2G is found as a standalone ligand1 entries where S2G is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	18
Chiral Atom Count	1
Bond Count	17
Aromatic Bond Count	0

2D diagram of S2G

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Chemical Component Summary
Name	(2S)-2-HYDROXYPENTANEDIOIC ACID
Systematic Name (OpenEye OEToolkits)	(2S)-2-hydroxypentanedioic acid
Formula	C₅ H₈ O₅
Molecular Weight	148.114
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(O)CCC(=O)O
SMILES	CACTVS	3.370	O[CH](CCC(O)=O)C(O)=O
SMILES	OpenEye OEToolkits	1.7.0	C(CC(=O)O)C(C(=O)O)O
Canonical SMILES	CACTVS	3.370	O[C@@H](CCC(O)=O)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.0	C(CC(=O)O)[C@@H](C(=O)O)O
InChI	InChI	1.03	InChI=1S/C5H8O5/c6-3(5(9)10)1-2-4(7)8/h3,6H,1-2H2,(H,7,8)(H,9,10)/t3-/m0/s1
InChIKey	InChI	1.03	HWXBTNAVRSUOJR-VKHMYHEASA-N

Related Resource References

Resource Name	Reference
PubChem	439939
ChEMBL	CHEMBL1615211
ChEBI	CHEBI:32797

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