X6X

2-amino-2-deoxy-alpha-D-galactopyranose

Created:	2015-06-03
Last modified:	2020-07-17

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4 entries where X6X is found as a standalone ligand1 entries where X6X is found in a branched oligosaccharide

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	5
Bond Count	25
Aromatic Bond Count	0

2D diagram of X6X

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Chemical Component Summary
Name	2-amino-2-deoxy-alpha-D-galactopyranose
Synonyms	alpha-D-galactosamine; 2-amino-2-deoxy-alpha-D-galactose; 2-amino-2-deoxy-D-galactose; 2-amino-2-deoxy-galactose
Systematic Name (OpenEye OEToolkits)	(2S,3R,4R,5R,6R)-3-azanyl-6-(hydroxymethyl)oxane-2,4,5-triol
Formula	C₆ H₁₃ N O₅
Molecular Weight	179.171
Type	D-SACCHARIDE, ALPHA LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	OC1C(OC(C(C1O)N)O)CO
SMILES	CACTVS	3.385	N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O
SMILES	OpenEye OEToolkits	1.9.2	C(C1C(C(C(C(O1)O)N)O)O)O
Canonical SMILES	CACTVS	3.385	N[C@H]1[C@@H](O)O[C@H](CO)[C@H](O)[C@@H]1O
Canonical SMILES	OpenEye OEToolkits	1.9.2	C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O)N)O)O)O
InChI	InChI	1.03	InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6+/m1/s1
InChIKey	InChI	1.03	MSWZFWKMSRAUBD-DVKNGEFBSA-N

Related Resource References

Resource Name	Reference
PubChem	5317448
ChEBI	CHEBI:148869

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