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Details

Stereochemistry ACHIRAL
Molecular Formula C18H15NO3
Molecular Weight 293.3166
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DELMETACIN

SMILES

CC1=C(CC(O)=O)C2=C(C=CC=C2)N1C(=O)C3=CC=CC=C3

InChI

InChIKey=AZCOEIZFVQEQCU-UHFFFAOYSA-N
InChI=1S/C18H15NO3/c1-12-15(11-17(20)21)14-9-5-6-10-16(14)19(12)18(22)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,20,21)

HIDE SMILES / InChI

Molecular Formula C18H15NO3
Molecular Weight 293.3166
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:39:23 GMT 2023
Edited
by admin
on Fri Dec 15 16:39:23 GMT 2023
Record UNII
I9Q51XHI1K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DELMETACIN
INN  
INN  
Official Name English
delmetacin [INN]
Common Name English
1-BENZOYL-2-METHYLINDOLE-3-ACETIC ACID
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C257
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
Code System Code Type Description
INN
4628
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
CAS
16401-80-2
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
SMS_ID
100000083687
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
EVMPD
SUB06955MIG
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
PUBCHEM
27860
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
MESH
C038037
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
FDA UNII
I9Q51XHI1K
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104243
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID90167696
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
NCI_THESAURUS
C76801
Created by admin on Fri Dec 15 16:39:23 GMT 2023 , Edited by admin on Fri Dec 15 16:39:23 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY