GDL

2-(acetylamido)-2-deoxy-D-glucono-1,5-lactone

Created:	2002-10-29
Last modified:	2020-07-17

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4 entries where GDL is found as a standalone ligand2 entries where GDL is found in a branched oligosaccharide

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	4
Bond Count	28
Aromatic Bond Count	0

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Chemical Component Summary
Name	2-(acetylamido)-2-deoxy-D-glucono-1,5-lactone
Synonyms	2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-LACTONE
Systematic Name (OpenEye OEToolkits)	N-[(3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-oxo-oxan-3-yl]ethanamide
Formula	C₈ H₁₃ N O₆
Molecular Weight	219.192
Type	D-SACCHARIDE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C1OC(CO)C(O)C(O)C1NC(=O)C
SMILES	CACTVS	3.341	CC(=O)N[CH]1[CH](O)[CH](O)[CH](CO)OC1=O
SMILES	OpenEye OEToolkits	1.5.0	CC(=O)NC1C(C(C(OC1=O)CO)O)O
Canonical SMILES	CACTVS	3.341	CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)OC1=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1=O)CO)O)O
InChI	InChI	1.03	InChI=1S/C8H13NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-7,10,12-13H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-/m1/s1
InChIKey	InChI	1.03	NELQYZRSPDCGRQ-DBRKOABJSA-N

Drug Info: DrugBank

DrugBank ID	DB02813
Name	2-Acetamido-2-Deoxy-D-Glucono-1,5-Lactone
Groups	experimental
Synonyms	2-Acetamido-2-Deoxy-D-Glucono-1,5-Lactone
CAS number	19026-22-3

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Beta-hexosaminidase subunit beta	MELCGLGLPRPPMLLALLLATLLAAMLALLTQVALVVQVAEAARAPSVSA...	unknown
Chitinase B	MSTRKAVIGYYFIPTNQINNYTETDTSVVPFPVSNITPAKAKQLTHINFS...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682