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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H21N8O6S4.H
Molecular Weight 622.72
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CEFTAROLINE M-1

SMILES

[H+].[H][C@]1(NC(C([O-])=O)=C(CS1)SC2=NC(=CS2)C3=CC=[N+](C)C=C3)[C@H](NC(=O)C(=N/OCC)\C4=NSC(N)=N4)C([O-])=O

InChI

InChIKey=YXIOPLJUAOXODC-BRZRCAQJSA-N
InChI=1S/C22H22N8O6S4/c1-3-36-28-14(16-27-21(23)40-29-16)17(31)25-15(20(34)35)18-26-13(19(32)33)12(9-37-18)39-22-24-11(8-38-22)10-4-6-30(2)7-5-10/h4-8,15,18,26H,3,9H2,1-2H3,(H4-,23,25,27,29,31,32,33,34,35)/b28-14-/t15-,18+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CEFTAROLINE M-1
Common Name English
PYRIDINIUM, 4-(2-(((2R)-2-((R)-(((2Z)-2-(5-AMINO-1,2,4-THIADIAZOL-3-YL)-2-(ETHOXYIMINO)ACETYL)AMINO)CARBOXYMETHYL)-4-CARBOXY-3,6-DIHYDRO-2H-1,3-THIAZIN-5-YL)THIO)-4-THIAZOLYL)-1-METHYL-, INNER SALT
Systematic Name English
.BETA.-LACTAM OPEN-RING CEFTAROLINE
Common Name English
CEFTAROLINE FOSAMIL METABOLITE (CEFTAROLINE M-1 )
Common Name English
Code System Code Type Description
PUBCHEM
131871813
Created by admin on Sat Dec 16 08:48:45 GMT 2023 , Edited by admin on Sat Dec 16 08:48:45 GMT 2023
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CAS
1286218-70-9
Created by admin on Sat Dec 16 08:48:45 GMT 2023 , Edited by admin on Sat Dec 16 08:48:45 GMT 2023
PRIMARY
FDA UNII
H1L2DSY2CM
Created by admin on Sat Dec 16 08:48:45 GMT 2023 , Edited by admin on Sat Dec 16 08:48:45 GMT 2023
PRIMARY