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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16O6
Molecular Weight 268.2625
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-CARBOXY-3,5-DIHYDROXYBENZENEHEXANOIC ACID

SMILES

OC(=O)CCCCCC1=C(C(O)=O)C(O)=CC(O)=C1

InChI

InChIKey=ILUGAGUIUJIPHM-UHFFFAOYSA-N
InChI=1S/C13H16O6/c14-9-6-8(4-2-1-3-5-11(16)17)12(13(18)19)10(15)7-9/h6-7,14-15H,1-5H2,(H,16,17)(H,18,19)

HIDE SMILES / InChI

Molecular Formula C13H16O6
Molecular Weight 268.2625
Charge 0
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 Mon Mar 31 19:19:44 GMT 2025
Edited
by admin
on Mon Mar 31 19:19:44 GMT 2025
Record UNII
FFL5R85RKZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-CARBOXY-3,5-DIHYDROXYBENZENEHEXANOIC ACID
Systematic Name English
BENZENEHEXANOIC ACID, 2-CARBOXY-3,5-DIHYDROXY-
Preferred Name English
Code System Code Type Description
FDA UNII
FFL5R85RKZ
Created by admin on Mon Mar 31 19:19:44 GMT 2025 , Edited by admin on Mon Mar 31 19:19:44 GMT 2025
PRIMARY
EPA CompTox
DTXSID50205826
Created by admin on Mon Mar 31 19:19:44 GMT 2025 , Edited by admin on Mon Mar 31 19:19:44 GMT 2025
PRIMARY
CAS
57193-62-1
Created by admin on Mon Mar 31 19:19:44 GMT 2025 , Edited by admin on Mon Mar 31 19:19:44 GMT 2025
PRIMARY
PUBCHEM
6453448
Created by admin on Mon Mar 31 19:19:44 GMT 2025 , Edited by admin on Mon Mar 31 19:19:44 GMT 2025
PRIMARY