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Details

Stereochemistry ACHIRAL
Molecular Formula C15H22O4
Molecular Weight 266.3328
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(5-(HYDROXYMETHYL)-2-METHYLPHENOXY)-2,2-DIMETHYLPENTANOIC ACID

SMILES

CC1=C(OCCCC(C)(C)C(O)=O)C=C(CO)C=C1

InChI

InChIKey=QTBNDWGXAYVPOX-UHFFFAOYSA-N
InChI=1S/C15H22O4/c1-11-5-6-12(10-16)9-13(11)19-8-4-7-15(2,3)14(17)18/h5-6,9,16H,4,7-8,10H2,1-3H3,(H,17,18)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
5-(5-(HYDROXYMETHYL)-2-METHYLPHENOXY)-2,2-DIMETHYLPENTANOIC ACID
Systematic Name English
GEMFIBROZIL METABOLITE M1
Common Name English
PENTANOIC ACID, 5-(5-(HYDROXYMETHYL)-2-METHYLPHENOXY)-2,2-DIMETHYL-
Systematic Name English
Code System Code Type Description
CAS
63257-53-4
Created by admin on Sat Dec 16 17:13:11 GMT 2023 , Edited by admin on Sat Dec 16 17:13:11 GMT 2023
PRIMARY
PUBCHEM
71373063
Created by admin on Sat Dec 16 17:13:11 GMT 2023 , Edited by admin on Sat Dec 16 17:13:11 GMT 2023
PRIMARY
FDA UNII
3XR748SU0W
Created by admin on Sat Dec 16 17:13:11 GMT 2023 , Edited by admin on Sat Dec 16 17:13:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID40795903
Created by admin on Sat Dec 16 17:13:11 GMT 2023 , Edited by admin on Sat Dec 16 17:13:11 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of GEMFIBROZIL
NIH
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