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Details

Stereochemistry ACHIRAL
Molecular Formula C20H23N2O5S.Na
Molecular Weight 426.462
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MCC-950 SODIUM

SMILES

[Na+].CC(C)(O)C1=COC(=C1)S(=O)(=O)[N-]C(=O)NC2=C3CCCC3=CC4=C2CCC4

InChI

InChIKey=LFQQNXFKPNZRFT-UHFFFAOYSA-M
InChI=1S/C20H24N2O5S.Na/c1-20(2,24)14-10-17(27-11-14)28(25,26)22-19(23)21-18-15-7-3-5-12(15)9-13-6-4-8-16(13)18;/h9-11,24H,3-8H2,1-2H3,(H2,21,22,23);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C20H23N2O5S
Molecular Weight 403.472
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Q96P20|||Q59H68
Gene ID: 114548.0
Gene Symbol: NLRP3
Target Organism: Homo sapiens (Human)
Substance Class Chemical
Created
by admin
on Sat Dec 16 16:11:57 GMT 2023
Edited
by admin
on Sat Dec 16 16:11:57 GMT 2023
Record UNII
66BL55B687
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MCC-950 SODIUM
Common Name English
CP-456773 SODIUM SALT
Code English
2-FURANSULFONAMIDE, N-(((1,2,3,5,6,7-HEXAHYDRO-S-INDACEN-4-YL)AMINO)CARBONYL)-4-(1-HYDROXY-1-METHYLETHYL)-, MONOSODIUM SALT
Systematic Name English
MCC-950 SODIUM SALT
Code English
MCC950 SODIUM SALT
Code English
CP-456,773 SODIUM SALT
Code English
Code System Code Type Description
PUBCHEM
91826093
Created by admin on Sat Dec 16 16:11:57 GMT 2023 , Edited by admin on Sat Dec 16 16:11:57 GMT 2023
PRIMARY
CAS
256373-96-3
Created by admin on Sat Dec 16 16:11:57 GMT 2023 , Edited by admin on Sat Dec 16 16:11:57 GMT 2023
PRIMARY
FDA UNII
66BL55B687
Created by admin on Sat Dec 16 16:11:57 GMT 2023 , Edited by admin on Sat Dec 16 16:11:57 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY