Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C25H26NO5.Na |
Molecular Weight | 443.4674 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CCC1=C(CCOC2=CC=C3[C@H](CC([O-])=O)CCC3=C2)N=C(O1)C4=CC=C(OC)C=C4
InChI
InChIKey=ICCAFCVDQOALPN-FERBBOLQSA-M
InChI=1S/C25H27NO5.Na/c1-3-23-22(26-25(31-23)16-6-8-19(29-2)9-7-16)12-13-30-20-10-11-21-17(14-20)4-5-18(21)15-24(27)28;/h6-11,14,18H,3-5,12-13,15H2,1-2H3,(H,27,28);/q;+1/p-1/t18-;/m0./s1
Molecular Formula | C25H26NO5 |
Molecular Weight | 420.4776 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 19:47:53 GMT 2023
by
admin
on
Fri Dec 15 19:47:53 GMT 2023
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Record UNII |
YZ6UUQ5JUZ
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Record Status |
Validated (UNII)
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Record Version |
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YZ6UUQ5JUZ
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49839871
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1258076-66-2
Created by
admin on Fri Dec 15 19:47:53 GMT 2023 , Edited by admin on Fri Dec 15 19:47:53 GMT 2023
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |
Originator: Bayer HealthCare Pharmaceuticals; Developer: DARA BioSciences, T3D Therapeutics; Class: Antihyperglycaemic, Insulin sensitiser, Small molecule; Mechanism of Action: Peroxisome proliferator-activated receptor delta agonist, Peroxisome proliferator-activated receptor gamma agonist; Highest Development Phases: Phase I/II Alzheimer's disease, Discontinued for Dyslipidaemia, Type 2 diabetes mellitus; Most Recent Events: 01 Jul 2015 Phase-I/II clinical trials in Alzheimer's disease (In the elderly, In adults) in USA (PO) (NCT02560753), 18 Jun 2013 Discontinued - Phase-I for Type-2 diabetes mellitus in USA (PO), 18 Jun 2013 Discontinued - Phase-I for Dyslipidaemias in USA (PO)
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