CEFTAROLINE M-1

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 Search

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

Molecular Formula	H
Molecular Weight	1.0079
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C22H21N8O6S4
Molecular Weight	621.712
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 08:48:45 UTC 2023` Edited by `admin` on `Sat Dec 16 08:48:45 UTC 2023`
Record UNII	H1L2DSY2CM
Record Status	`Validated (UNII)`
Record Version

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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 UTC 2023 , Edited by admin on Sat Dec 16 08:48:45 UTC 2023

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CAS

1286218-70-9

Created by admin on Sat Dec 16 08:48:45 UTC 2023 , Edited by admin on Sat Dec 16 08:48:45 UTC 2023

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FDA UNII

H1L2DSY2CM

Created by admin on Sat Dec 16 08:48:45 UTC 2023 , Edited by admin on Sat Dec 16 08:48:45 UTC 2023

PRIMARY

Related Record Type Details


					7P6FQA5D21

CEFTAROLINE FOSAMIL

PARENT -> METABOLITE INACTIVE

Amount: