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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H24N5O8S2.Na.H2O
Molecular Weight 579.579
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MEZLOCILLIN SODIUM MONOHYDRATE

SMILES

O.[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](NC(=O)N3CCN(C3=O)S(C)(=O)=O)C4=CC=CC=C4)C([O-])=O

InChI

InChIKey=CZXDIDROKIDGNE-SYNJJEHYSA-M
InChI=1S/C21H25N5O8S2.Na.H2O/c1-21(2)14(18(29)30)26-16(28)13(17(26)35-21)22-15(27)12(11-7-5-4-6-8-11)23-19(31)24-9-10-25(20(24)32)36(3,33)34;;/h4-8,12-14,17H,9-10H2,1-3H3,(H,22,27)(H,23,31)(H,29,30);;1H2/q;+1;/p-1/t12-,13-,14+,17-;;/m1../s1

HIDE SMILES / InChI

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

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C21H25N5O8S2
Molecular Weight 539.582
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:11:36 UTC 2023
Edited
by admin
on Fri Dec 15 15:11:36 UTC 2023
Record UNII
3CWW8B5904
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MEZLOCILLIN SODIUM MONOHYDRATE
ORANGE BOOK   WHO-DD  
Common Name English
MEZLOCILLIN SODIUM SALT MONOHYDRATE
MI  
Common Name English
BAYCIPEN
Brand Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-6-(((2R)-(((3-(METHYLSULFONYL)-2-OXO-1-IMIDAZOLIDINYL)CARBONYL)AMINO)PHENYLACETYL)AMINO)-7-OXO-, MONOSODIUM SALT, MONOHYDRATE, (2S,5R,6R)-
Common Name English
SODIUM (2S,5R,6R)-3,3-DIMETHYL-6-((R)-2-(3-(METHYLSULFONYL)-2-OXO-1-IMIDAZOLIDINECARBOXAMIDO)-2-PHENYLACETAMIDO)-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLATE, MONOHYDRATE
Common Name English
Mezlocillin sodium monohydrate [WHO-DD]
Common Name English
MEZLOCILLIN SODIUM SALT MONOHYDRATE [MI]
Common Name English
MEZLOCILLIN SODIUM [JAN]
Common Name English
MEZLIN
Brand Name English
BAYPEN
Brand Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-6-(((((3-(METHYLSULFONYL)-2-OXO-1-IMIDAZOLIDINYL)CARBONYL)AMINO)PHENYLACETYL)AMINO)-7-OXO-, MONOSODIUM SALT, MONOHYDRATE (2S-(2.ALPHA.,5.ALPHA.,6.BETA.(S*)))-
Common Name English
MEZLOCILLIN SODIUM MONOHYDRATE [ORANGE BOOK]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1500
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID001001279
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
CHEBI
6919
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
MERCK INDEX
m7520
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY Merck Index
SMS_ID
100000169918
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
EVMPD
SUB183639
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
FDA UNII
3CWW8B5904
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
PUBCHEM
23677831
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
NCI_THESAURUS
C87369
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
ChEMBL
CHEMBL1731
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
WIKIPEDIA
Mezlocillin sodium monohydrate
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
CAS
80495-46-1
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
DRUG BANK
DBSALT001339
Created by admin on Fri Dec 15 15:11:36 UTC 2023 , Edited by admin on Fri Dec 15 15:11:36 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
ANHYDROUS->SOLVATE
Related Record Type Details
ACTIVE MOIETY