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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H18F3N4O8P
Molecular Weight 530.3479
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MRX-4

SMILES

CC(=O)OP(O)(=O)N(C[C@H]1CN(C(=O)O1)C2=C(F)C(F)=C(N3CCC(=O)C=C3)C(F)=C2)C4=NOC=C4

InChI

InChIKey=YCRAGJLWFBGKFE-CYBMUJFWSA-N
InChI=1S/C20H18F3N4O8P/c1-11(28)35-36(31,32)27(16-4-7-33-24-16)10-13-9-26(20(30)34-13)15-8-14(21)19(18(23)17(15)22)25-5-2-12(29)3-6-25/h2,4-5,7-8,13H,3,6,9-10H2,1H3,(H,31,32)/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H18F3N4O8P
Molecular Weight 530.3479
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:54:21 UTC 2023
Edited
by admin
on Sat Dec 16 11:54:21 UTC 2023
Record UNII
CJZ0KB5903
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MRX-4
Common Name English
ACETIC ACID, ANHYDRIDE WITH N-(((5R)-3-(4-(3,4-DIHYDRO-4-OXO-1(2H)-PYRIDINYL)-2,3,5-TRIFLUOROPHENYL)-2-OXO-5-OXAZOLIDINYL)METHYL)-N-3-ISOXAZOLYLPHOSPHORAMIDIC ACID
Systematic Name English
PRODRUG OF CONTEZOLID (MRX-1)
Common Name English
Code System Code Type Description
SMS_ID
300000037529
Created by admin on Sat Dec 16 11:54:21 UTC 2023 , Edited by admin on Sat Dec 16 11:54:21 UTC 2023
PRIMARY
PUBCHEM
91864617
Created by admin on Sat Dec 16 11:54:21 UTC 2023 , Edited by admin on Sat Dec 16 11:54:21 UTC 2023
PRIMARY
FDA UNII
CJZ0KB5903
Created by admin on Sat Dec 16 11:54:21 UTC 2023 , Edited by admin on Sat Dec 16 11:54:21 UTC 2023
PRIMARY
CAS
1807497-11-5
Created by admin on Sat Dec 16 11:54:21 UTC 2023 , Edited by admin on Sat Dec 16 11:54:21 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
METABOLITE ACTIVE -> PRODRUG
Related Record Type Details
ACTIVE MOIETY