Y-27632 (CHEBI:75393)

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ChEBI Name	Y-27632

ChEBI ID	CHEBI:75393

Definition	A monocarboxylic acid amide that is trans-[(1R)-1-aminoethyl]cyclohexanecarboxamide in which one of the nitrogens of the aminocarbony group is substituted by a pyridine nucleus. It has been shown to exhibit inhibitory activity against Rho-associated protein kinase (ROCK) enzyme.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C14H21N3O

Net Charge

Average Mass

247.33600

Monoisotopic Mass

247.16846

InChI

InChI=1S/C14H21N3O/c1-10(15)11-2-4-12(5-3-11)14(18)17-13-6-8-16-9-7-13/h6-12H,2-5,15H2,1H3,(H,16,17,18)/t10-,11-,12-/m1/s1

InChIKey

IYOZTVGMEWJPKR-IJLUTSLNSA-N

SMILES

C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc1ccncc1

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of non-specific serine/threonine protein kinase (EC 2.7.11.1), a kinase enzyme involved in phosphorylation of hydroxy group of serine or threonine.

ChEBI Ontology
Outgoing	Y-27632 (CHEBI:75393) has role EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor (CHEBI:50925) Y-27632 (CHEBI:75393) is a monocarboxylic acid amide (CHEBI:29347) Y-27632 (CHEBI:75393) is a primary amino compound (CHEBI:50994) Y-27632 (CHEBI:75393) is a pyridines (CHEBI:26421)

IUPAC Name

trans-4-[(1R)-1-aminoethyl]-N-(pyridin-4-yl)cyclohexanecarboxamide

Synonyms	Sources
(R)-(+)-trans-N-(4-pyridyl)-4-(1-aminoethyl)-cyclohexanecarboxamide	ChEBI
4-[(1R)-1-aminoethyl]-N-(pyridin-4-yl)cyclohexane-1-carboxamide	IUPHAR
Y 27632	ChEBI

Last Modified

07 October 2013