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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-(4-HYDROXY-2,5-DIMETHYLPHENOXY)-2,2-DIMETHYLPENTANOIC ACID

SMILES

CC1=CC(OCCCC(C)(C)C(O)=O)=C(C)C=C1O

InChI

InChIKey=VJICDPYDJADQNH-UHFFFAOYSA-N
InChI=1S/C15H22O4/c1-10-9-13(11(2)8-12(10)16)19-7-5-6-15(3,4)14(17)18/h8-9,16H,5-7H2,1-4H3,(H,17,18)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
5-(4-HYDROXY-2,5-DIMETHYLPHENOXY)-2,2-DIMETHYLPENTANOIC ACID
Systematic Name English
GEMFIBROZIL METABOLITE M2
Common Name English
PENTANOIC ACID, 5-(4-HYDROXY-2,5-DIMETHYLPHENOXY)-2,2-DIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
Q78ZH02Q2F
Created by admin on Sat Dec 16 17:42:45 GMT 2023 , Edited by admin on Sat Dec 16 17:42:45 GMT 2023
PRIMARY
CAS
80373-12-2
Created by admin on Sat Dec 16 17:42:45 GMT 2023 , Edited by admin on Sat Dec 16 17:42:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID80440081
Created by admin on Sat Dec 16 17:42:45 GMT 2023 , Edited by admin on Sat Dec 16 17:42:45 GMT 2023
PRIMARY
PUBCHEM
10445630
Created by admin on Sat Dec 16 17:42:45 GMT 2023 , Edited by admin on Sat Dec 16 17:42:45 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of GEMFIBROZIL
NIH
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