TA6

6-O-phosphono-beta-D-tagatofuranose

Created:	2006-03-24
Last modified:	2020-07-17

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3 entries where TA6 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	4
Bond Count	29
Aromatic Bond Count	0

2D diagram of TA6

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Chemical Component Summary
Name	6-O-phosphono-beta-D-tagatofuranose
Synonyms	6-O-phosphono-beta-D-tagatose; 6-O-phosphono-D-tagatose; 6-O-phosphono-tagatose
Systematic Name (OpenEye OEToolkits)	[(2R,3R,4S,5R)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl dihydrogen phosphate
Formula	C₆ H₁₃ O₉ P
Molecular Weight	260.136
Type	D-SACCHARIDE, BETA LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=P(O)(O)OCC1OC(O)(CO)C(O)C1O
SMILES	CACTVS	3.341	OC[C]1(O)O[CH](CO[P](O)(O)=O)[CH](O)[CH]1O
SMILES	OpenEye OEToolkits	1.5.0	C(C1C(C(C(O1)(CO)O)O)O)OP(=O)(O)O
Canonical SMILES	CACTVS	3.341	OC[C@@]1(O)O[C@H](CO[P](O)(O)=O)[C@H](O)[C@@H]1O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C([C@@H]1[C@@H]([C@@H]([C@](O1)(CO)O)O)O)OP(=O)(O)O
InChI	InChI	1.03	InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4+,5+,6-/m1/s1
InChIKey	InChI	1.03	BGWGXPAPYGQALX-DPYQTVNSSA-N

Related Resource References

Resource Name	Reference
PubChem	9543488
ChEBI	CHEBI:45804

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