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Details

Stereochemistry ACHIRAL
Molecular Formula C11H7N5O4.ClH
Molecular Weight 309.665
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of YM-90K

SMILES

Cl.[O-][N+](=O)C1=C(C=C2NC(=O)C(=O)NC2=C1)N3C=CN=C3

InChI

InChIKey=UMLFDVOHVJPDIZ-UHFFFAOYSA-N
InChI=1S/C11H7N5O4.ClH/c17-10-11(18)14-7-4-9(16(19)20)8(3-6(7)13-10)15-2-1-12-5-15;/h1-5H,(H,13,17)(H,14,18);1H

HIDE SMILES / InChI

Molecular Formula C11H7N5O4
Molecular Weight 273.2044
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
142.0 µM [IC50]
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:32:25 GMT 2023
Edited
by admin
on Fri Dec 15 15:32:25 GMT 2023
Record UNII
UAEXCLWI0Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
YM-90K
Code English
6-(1H-IMIDAZOL-1-YL)-7-NITRO-2,3(1H,4H)-QUINOXALINEDIONE HYDROCHLORIDE
Systematic Name English
2,3-QUINOXALINEDIONE, 1,4-DIHYDRO-6-(1H-IMIDAZOL-1-YL)-7-NITRO-, MONOHYDROCHLORIDE
Common Name English
2,3-QUINOXALINEDIONE, 1,4-DIHYDRO-6-(1H-IMIDAZOL-1-YL)-7-NITRO-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
5486547
Created by admin on Fri Dec 15 15:32:25 GMT 2023 , Edited by admin on Fri Dec 15 15:32:25 GMT 2023
PRIMARY
CAS
154164-30-4
Created by admin on Fri Dec 15 15:32:25 GMT 2023 , Edited by admin on Fri Dec 15 15:32:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID00165547
Created by admin on Fri Dec 15 15:32:25 GMT 2023 , Edited by admin on Fri Dec 15 15:32:25 GMT 2023
PRIMARY
FDA UNII
UAEXCLWI0Q
Created by admin on Fri Dec 15 15:32:25 GMT 2023 , Edited by admin on Fri Dec 15 15:32:25 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE