BZD

N-[(phenylcarbonyl)carbamoyl]-beta-D-glucopyranosylamine

Created:	2001-09-20
Last modified:	2020-07-17

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3 entries where BZD is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	41
Chiral Atom Count	5
Bond Count	42
Aromatic Bond Count	6

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Chemical Component Summary
Name	N-[(phenylcarbonyl)carbamoyl]-beta-D-glucopyranosylamine
Synonyms	N-BENZOYL-N'-BETA-D-GLUCOPYRANOSYL UREA; N-[(phenylcarbonyl)carbamoyl]-beta-D-glucosylamine; N-[(phenylcarbonyl)carbamoyl]-D-glucosylamine; N-[(phenylcarbonyl)carbamoyl]-glucosylamine
Systematic Name (OpenEye OEToolkits)	N-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]carbamoyl]benzamide
Formula	C₁₄ H₁₈ N₂ O₇
Molecular Weight	326.302
Type	D-SACCHARIDE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c2ccccc2
SMILES	CACTVS	3.341	OC[CH]1O[CH](NC(=O)NC(=O)c2ccccc2)[CH](O)[CH](O)[CH]1O
SMILES	OpenEye OEToolkits	1.5.0	c1ccc(cc1)C(=O)NC(=O)NC2C(C(C(C(O2)CO)O)O)O
Canonical SMILES	CACTVS	3.341	OC[C@H]1O[C@@H](NC(=O)NC(=O)c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1ccc(cc1)C(=O)NC(=O)N[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChI	InChI	1.03	InChI=1S/C14H18N2O7/c17-6-8-9(18)10(19)11(20)13(23-8)16-14(22)15-12(21)7-4-2-1-3-5-7/h1-5,8-11,13,17-20H,6H2,(H2,15,16,21,22)/t8-,9-,10+,11-,13-/m1/s1
InChIKey	InChI	1.03	JSBCZGSPFATCOV-BZNQNGANSA-N

Drug Info: DrugBank

DrugBank ID	DB04295
Name	N-(Benzoylcarbamoyl)-beta-D-glucopyranosylamine
Groups	experimental
Synonyms	N-(Benzoylcarbamoyl)-beta-D-glucopyranosylamine N-benzoyl-N'-beta-D-glucopyranosyl urea
Categories	Amides Carbohydrates Glycogen Phosphorylase, antagonists & inhibitors Hexoses Monosaccharides

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Glycogen phosphorylase, muscle form	MSRPLSDQEKRKQISVRGLAGVENVTELKKNFNRHLHFTLVKDRNVATPR...	unknown	inhibitor

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