XUL

D-XYLULOSE

Created:	1999-07-08
Last modified:	2011-06-04

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10 entries where XUL is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	20
Chiral Atom Count	2
Bond Count	19
Aromatic Bond Count	0

2D diagram of XUL

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Chemical Component Summary
Name	D-XYLULOSE
Systematic Name (OpenEye OEToolkits)	(3S,4R)-1,3,4,5-tetrahydroxypentan-2-one
Formula	C₅ H₁₀ O₅
Molecular Weight	150.13
Type	D-SACCHARIDE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(CO)C(O)C(O)CO
SMILES	CACTVS	3.341	OC[CH](O)[CH](O)C(=O)CO
SMILES	OpenEye OEToolkits	1.5.0	C(C(C(C(=O)CO)O)O)O
Canonical SMILES	CACTVS	3.341	OC[C@@H](O)[C@H](O)C(=O)CO
Canonical SMILES	OpenEye OEToolkits	1.5.0	C([C@H]([C@@H](C(=O)CO)O)O)O
InChI	InChI	1.03	InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h3,5-8,10H,1-2H2/t3-,5+/m1/s1
InChIKey	InChI	1.03	ZAQJHHRNXZUBTE-WUJLRWPWSA-N

Related Resource References

Resource Name	Reference
PubChem	5289590
ChEMBL	CHEMBL195094
ChEBI	CHEBI:17140

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.