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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H19Cl2NO8
Molecular Weight 472.2734
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICLOFENAC GLUCURONIDE

SMILES

c1ccc(c(c1)CC(=O)O[C@@]2([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O)O2)O)O)O)Nc3c(cccc3Cl)Cl

InChI

InChIKey=JXIKYYSIYCILNG-HBWRTXEVSA-N
InChI=1S/C20H19Cl2NO8/c21-10-5-3-6-11(22)14(10)23-12-7-2-1-4-9(12)8-13(24)30-20-17(27)15(25)16(26)18(31-20)19(28)29/h1-7,15-18,20,23,25-27H,8H2,(H,28,29)/t15-,16-,17+,18-,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H19Cl2NO8
Molecular Weight 472.2734
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 10:00:21 UTC 2021
Edited
by admin
on Sat Jun 26 10:00:21 UTC 2021
Record UNII
C8BEZ13XEN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICLOFENAC GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-(2-((2,6-DICHLOROPHENYL)AMINO)BENZENEACETATE)
Systematic Name English
DICLOFENAC-.BETA.-D-GLUCURONIDE
Common Name English
Code System Code Type Description
PUBCHEM
16084218
Created by admin on Sat Jun 26 10:00:21 UTC 2021 , Edited by admin on Sat Jun 26 10:00:21 UTC 2021
PRIMARY
CAS
64118-81-6
Created by admin on Sat Jun 26 10:00:21 UTC 2021 , Edited by admin on Sat Jun 26 10:00:21 UTC 2021
PRIMARY
FDA UNII
C8BEZ13XEN
Created by admin on Sat Jun 26 10:00:21 UTC 2021 , Edited by admin on Sat Jun 26 10:00:21 UTC 2021
PRIMARY
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