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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H17N6O5S2.Na
Molecular Weight 484.485
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CEFAMANDOLE SODIUM

SMILES

[Na+].[H][C@]12SCC(CSC3=NN=NN3C)=C(N1C(=O)[C@H]2NC(=O)[C@H](O)C4=CC=CC=C4)C([O-])=O

InChI

InChIKey=OJMNTWPPFNMOCJ-CFOLLTDRSA-M
InChI=1S/C18H18N6O5S2.Na/c1-23-18(20-21-22-23)31-8-10-7-30-16-11(15(27)24(16)12(10)17(28)29)19-14(26)13(25)9-5-3-2-4-6-9;/h2-6,11,13,16,25H,7-8H2,1H3,(H,19,26)(H,28,29);/q;+1/p-1/t11-,13-,16-;/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 C18H17N6O5S2
Molecular Weight 461.495
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:49:52 UTC 2023
Edited
by admin
on Fri Dec 15 15:49:52 UTC 2023
Record UNII
IY6234ODVR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFAMANDOLE SODIUM
JAN   MART.   WHO-DD  
Common Name English
Monosodium (6R,7R)-7-(R)-mandelamido-3-[[(1-methyl-1-H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-((HYDROXYPHENYLACETYL)AMINO)-3-(((1-METHYL-1H-TETRAZOL-5-YL)THIO)METHYL)-8-OXO-, (6R-(6A,7B(R*)))-, MONOSODIUM SALT
Common Name English
NSC-758169
Code English
Cefamandole sodium [WHO-DD]
Common Name English
CEFAMANDOLE SODIUM [MART.]
Common Name English
CEFAMANDOLE SODIUM [JAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C357
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
Code System Code Type Description
PUBCHEM
23672568
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
EVMPD
SUB35548
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
ECHA (EC/EINECS)
250-009-0
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
ChEMBL
CHEMBL1146
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
FDA UNII
IY6234ODVR
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
EPA CompTox
DTXSID2045579
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
CAS
30034-03-8
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
NSC
758169
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
NCI_THESAURUS
C47967
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
SMS_ID
100000128479
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
CHEBI
34614
Created by admin on Fri Dec 15 15:49:52 UTC 2023 , Edited by admin on Fri Dec 15 15:49:52 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY