Repaglinide

Systematic / IUPAC Name: 2-Ethoxy-4-[2-({(1S)-3-methyl-1-[2-(1-piperidinyl)phenyl]butyl}amino)-2-oxoethyl]benzoic acid

ID: Reference2288

Other Names: Prandin;
Novonorm;
Gluconorm;
Repaglinidum;
Actulin ; more

Formula: C27H36N2O4

Class: Therapeutics/Prescription Drugs

Spectral Data

Repaglinide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 179
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/18/2015 10:23:49 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C27H36N2O4/c1-4-33-25-17-20(12-13-22(25)27(31)32)18-26(30)28-23(16-19(2)3)21-10-6-7-11-24(21)29-14-8-5-9-15-29/h6-7,10-13,17,19,23H,4-5,8-9,14-16,18H2,1-3H3,(H,28,30)(H,31,32)/t23-/m0/s1
InChI Key FAEKWTJYAYMJKF-QHCPKHFHSA-N
Canonical SMILES CCOC1=C(C=CC(=C1)CC(=O)NC(CC(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)O
CAS 135062021
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Other Names Prandin;
Novonorm;
Gluconorm;
Repaglinidum;
Actulin;
(+)-2-Ethoxy-α-{[(S)-α-isobutyl-o-piperidinobenzyl]carbamoyl}-p-toluic acid;
(S)-2-Ethoxy-4-[2-({3-methyl-1-[2-(piperidin-1-yl)phenyl]butyl}amino)-2-oxoethyl]benzoic acid;
Benzoic acid, 2-ethoxy-4-[2-({3-methyl-1-[2-(1-piperidinyl)phenyl]butyl}amino)-2-oxoethyl], (S)-;
(S)-(+)-2-Ethoxy-4-{N-[1-(2-piperidinophenyl)-3-methyl-1-butyl]aminocarbonylmethyl}benzoic acid;
2-Ethoxy-4-[2-({(1S)-3-methyl-1-[2-(piperidin-1-yl)phenyl]butyl}amino)-2-oxoethyl]benzoic acid;
(S)-2-Ethoxy-4-(2-{3-methyl-1-[2-(piperidin-1-yl)phenyl]butylamino}-2-oxoethyl)benzoic acid;
2-Ethoxy-4-({[(1S)-3-methyl-1-[2-(piperidin-1-yl)phenyl]butyl]carbamoyl}methyl)benzoic acid;
Benzoic acid, 2-ethoxy-4-[2-({(1S)-3-methyl-1-[2-(1-piperidinyl)phenyl]butyl}amino)-2-oxoethyl]-

In Other Databases

ChEMBL CHEMBL1272
ChemSpider 59377
DrugBank DB00912
KEGG C07670; D00594
Wikipedia Repaglinide
HMDb HMDB15048
PubChem 65981
ChemIDPlus 135062021