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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14N4O3
Molecular Weight 310.3074
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Danicopan metabolite M311

SMILES

CC(=O)C1=NN(CC(O)=O)C2=C1C=C(C=C2)C3=CN=C(C)N=C3

InChI

InChIKey=INDCSLFBKQSDAY-UHFFFAOYSA-N
InChI=1S/C16H14N4O3/c1-9(21)16-13-5-11(12-6-17-10(2)18-7-12)3-4-14(13)20(19-16)8-15(22)23/h3-7H,8H2,1-2H3,(H,22,23)

HIDE SMILES / InChI

Molecular Formula C16H14N4O3
Molecular Weight 310.3074
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 Wed Apr 02 19:49:03 GMT 2025
Edited
by admin
on Wed Apr 02 19:49:03 GMT 2025
Record UNII
82MB445WAQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-Indazole-1-acetic acid, 3-acetyl-5-(2-methyl-5-pyrimidinyl)-
Preferred Name English
Danicopan metabolite M311
Common Name English
3-Acetyl-5-(2-methyl-5-pyrimidinyl)-1H-indazole-1-acetic acid
Systematic Name English
Code System Code Type Description
FDA UNII
82MB445WAQ
Created by admin on Wed Apr 02 19:49:03 GMT 2025 , Edited by admin on Wed Apr 02 19:49:03 GMT 2025
PRIMARY
CAS
2086187-41-7
Created by admin on Wed Apr 02 19:49:03 GMT 2025 , Edited by admin on Wed Apr 02 19:49:03 GMT 2025
PRIMARY
PUBCHEM
126618634
Created by admin on Wed Apr 02 19:49:03 GMT 2025 , Edited by admin on Wed Apr 02 19:49:03 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE