CHEBI:131349 - (R)-Bay-K-8644

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ChEBI Name (R)-Bay-K-8644
ChEBI ID CHEBI:131349
ChEBI ASCII Name (R)-Bay-K-8644
Definition A methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate in which the 4-position has (R)-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C16H15F3N2O4
Net Charge 0
Average Mass 356.297
Monoisotopic Mass 356.09839
InChI InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3/t13-/m1/s1
InChIKey ZFLWDHHVRRZMEI-CYBMUJFWSA-N
SMILES [C@@]1(C(=C(NC(=C1[N+](=O)[O-])C)C)C(OC)=O)(C=2C(=CC=CC2)C(F)(F)F)[H]
ChEBI Ontology
Outgoing (R)-Bay-K-8644 (CHEBI:131349) is a methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate (CHEBI:131345)
(R)-Bay-K-8644 (CHEBI:131349) is enantiomer of (S)-Bay-K-8644 (CHEBI:131347)
Incoming Bay-K-8644 (CHEBI:34555) has part (R)-Bay-K-8644 (CHEBI:131349)
(S)-Bay-K-8644 (CHEBI:131347) is enantiomer of (R)-Bay-K-8644 (CHEBI:131349)
IUPAC Name
methyl (4R)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
Synonyms Sources
(+)-Bay K8644 ChEBI
(+)-Bay-K-8644 ChEBI
(+)-BayK8644 ChEBI
(R)-Bay K8644 ChEBI
(R)-BayK8644 ChEBI
Registry Number Type Source
7574443 Reaxys Registry Number Reaxys
Last Modified
29 February 2016