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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H16N8O7S3.2Na
Molecular Weight 598.544
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CEFTRIAXONE SODIUM ANHYDROUS

SMILES

[Na+].[Na+].[H][C@]12SCC(CSC3=NC(=O)C(=O)[N-]N3C)=C(N1C(=O)[C@H]2NC(=O)C(=N/OC)\C4=CSC(N)=N4)C([O-])=O

InChI

InChIKey=LTFQVRWXHBGEMZ-BBJOQENWSA-L
InChI=1S/C18H18N8O7S3.2Na/c1-25-18(22-12(28)13(29)23-25)36-4-6-3-34-15-9(14(30)26(15)10(6)16(31)32)21-11(27)8(24-33-2)7-5-35-17(19)20-7;;/h5,9,15H,3-4H2,1-2H3,(H5,19,20,21,23,27,29,31,32);;/q;2*+1/p-2/b24-8-;;/t9-,15-;;/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 C18H17N8O7S3
Molecular Weight 553.572
Charge -1
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 00:59:45 UTC 2023
Edited
by admin
on Sat Dec 16 00:59:45 UTC 2023
Record UNII
R598PB148Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFTRIAXONE SODIUM ANHYDROUS
Common Name English
SODIUM CEFTRIAXONE, ANHYDROUS
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2Z)-2-(2-AMINO-4-THIAZOLYL)-2-(METHOXYIMINO)ACETYL)AMINO)-8-OXO-3-(((1,2,5,6-TETRAHYDRO-2-METHYL-5,6-DIOXO-1,2,4-TRIAZIN-3-YL)THIO)METHYL)-, SODIUM SALT (1:2), (6R,7R)-
Common Name English
Ceftriaxone sodium [WHO-DD]
Common Name English
CEFTRIAXONE DISODIUM SALT [MI]
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2-AMINO-4-THIAZOLYL)(METHOXYIMINO)ACETYL)AMINO)-8-OXO-3-(((1,2,5,6-TETRAHYDRO-2-METHYL-5,6-DIOXO-1,2,4-TRIAZIN-3-YL)THIO)METHYL)-, DISODIUM SALT, (6R-(6.ALPHA.,7.BETA.(Z)))-
Common Name English
Code System Code Type Description
EVMPD
SUB168478
Created by admin on Sat Dec 16 00:59:46 UTC 2023 , Edited by admin on Sat Dec 16 00:59:46 UTC 2023
PRIMARY
ECHA (EC/EINECS)
277-930-0
Created by admin on Sat Dec 16 00:59:46 UTC 2023 , Edited by admin on Sat Dec 16 00:59:46 UTC 2023
PRIMARY
CAS
74578-69-1
Created by admin on Sat Dec 16 00:59:46 UTC 2023 , Edited by admin on Sat Dec 16 00:59:46 UTC 2023
PRIMARY
MERCK INDEX
m3225
Created by admin on Sat Dec 16 00:59:46 UTC 2023 , Edited by admin on Sat Dec 16 00:59:46 UTC 2023
PRIMARY
FDA UNII
R598PB148Q
Created by admin on Sat Dec 16 00:59:46 UTC 2023 , Edited by admin on Sat Dec 16 00:59:46 UTC 2023
PRIMARY
PUBCHEM
23715082
Created by admin on Sat Dec 16 00:59:46 UTC 2023 , Edited by admin on Sat Dec 16 00:59:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID501019136
Created by admin on Sat Dec 16 00:59:46 UTC 2023 , Edited by admin on Sat Dec 16 00:59:46 UTC 2023
PRIMARY
Related Record Type Details
SUBSTANCE->BASIS OF STRENGTH
SOLVATE->ANHYDROUS
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY