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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H14N8O5S4.ClH.H2O
Molecular Weight 569.058
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CEFMATILEN HYDROCHLORIDE MONOHYDRATE

SMILES

O.Cl.[H][C@]12SCC(SCSC3=CNN=N3)=C(N1C(=O)[C@H]2NC(=O)C(=N/O)\C4=CSC(N)=N4)C(O)=O

InChI

InChIKey=LBWIJMWZWJRRMO-AWXOXGPMSA-N
InChI=1S/C15H14N8O5S4.ClH.H2O/c16-15-18-5(2-30-15)8(21-28)11(24)19-9-12(25)23-10(14(26)27)6(3-29-13(9)23)31-4-32-7-1-17-22-20-7;;/h1-2,9,13,28H,3-4H2,(H2,16,18)(H,19,24)(H,26,27)(H,17,20,22);1H;1H2/b21-8-;;/t9-,13-;;/m1../s1

HIDE SMILES / InChI

Molecular Formula H2O
Molecular Weight 18.0153
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

Molecular Formula C15H14N8O5S4
Molecular Weight 514.582
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:27:03 UTC 2023
Edited
by admin
on Sat Dec 16 05:27:03 UTC 2023
Record UNII
PA4O9CKP1M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFMATILEN HYDROCHLORIDE MONOHYDRATE
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2-AMINO-4-THIAZOLYL)(HYDROXYIMINO)ACETYL)AMINO)-8-OXO-3-(((1H-1,2,3-TRIAZOL-4-YLTHIO)METHYL)THIO)-, MONOHYDROCHLORIDE, MONOHYDRATE, (6R-(6.ALPHA.,7.BETA.(Z)))-
Common Name English
CEFMATILEN MONOHYDROCHLORIDE MONOHYDRATE
Common Name English
CEFMATILEN HYDROCHLORIDE HYDRATE
JAN  
Common Name English
CEFMATILEN HYDROCHLORIDE HYDRATE [JAN]
Common Name English
(-)-CEFMATILEN MONOHYDROCHLORIDE MONOHYDRATE
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2Z)-(2-AMINO-4-THIAZOLYL)(HYDROXYIMINO)ACETYL)AMINO)-8-OXO-3-(((1H-1,2,3-TRIAZOL-4-YLTHIO)METHYL)THIO)-, MONOHYDROCHLORIDE, MONOHYDRATE, (6R,7R)-
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2Z)-2-(2-AMINO-4-THIAZOLYL)-2-(HYDROXYIMINO)ACETYL)AMINO)-8-OXO-3-(((1H-1,2,3-TRIAZOL-5-YLTHIO)METHYL)THIO)-, HYDROCHLORIDE, HYDRATE (1:1:1), (6R,7R)-
Common Name English
Code System Code Type Description
CAS
154776-45-1
Created by admin on Sat Dec 16 05:27:03 UTC 2023 , Edited by admin on Sat Dec 16 05:27:03 UTC 2023
PRIMARY
FDA UNII
PA4O9CKP1M
Created by admin on Sat Dec 16 05:27:03 UTC 2023 , Edited by admin on Sat Dec 16 05:27:03 UTC 2023
PRIMARY
PUBCHEM
9690121
Created by admin on Sat Dec 16 05:27:03 UTC 2023 , Edited by admin on Sat Dec 16 05:27:03 UTC 2023
PRIMARY
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