(Q27269656)

Repaglinide, (-)- (English)

14 October 2016

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₆N₂O₄

1 reference

Repaglinide, (-)- (English)

14 October 2016

canonical SMILES

CCOC1=C(C=CC(=C1)CC(=O)NC(CC(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)O

1 reference

Repaglinide, (-)- (English)

14 October 2016

isomeric SMILES

CCOC1=C(C=CC(=C1)CC(=O)N[C@H](CC(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)O

1 reference

Repaglinide, (-)- (English)

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-/m1/s1

14 October 2016

Identifiers

InChI

1 reference

Repaglinide, (-)- (English)

FAEKWTJYAYMJKF-HSZRJFAPSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

Repaglinide, (-)- (English)

14 October 2016

1 reference

UNII

85M30X62FM

(-)-repaglinide (English)

14 October 2016

1 reference

2-Ethoxy-4-[2-({(1R)-3-methyl-1-[2-(1-piperidinyl)phenyl]butyl}amino)-2-oxoethyl]benzoic acid (English)

14 October 2016

1 reference

Repaglinide, (-)- (English)

14 October 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

CHEMBL151767 (English)

14 October 2016

1 reference

1 reference

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

UNII

85M30X62FM

(-)-repaglinide (English)