Isocefalexin sodium

Details

Stereochemistry	EPIMERIC
Molecular Formula	C16H16N3O4S.Na
Molecular Weight	369.371
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[H][C@]12SCC(=C)C(N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CC=CC=C3)C([O-])=O

InChI

InChIKey=DVGUTDHFEQENNS-QWEQECPASA-M

InChI=1S/C16H17N3O4S.Na/c1-8-7-24-15-11(14(21)19(15)12(8)16(22)23)18-13(20)10(17)9-5-3-2-4-6-9;/h2-6,10-12,15H,1,7,17H2,(H,18,20)(H,22,23);/q;+1/p-1/t10-,11-,12?,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	C16H16N3O4S
Molecular Weight	346.381
Charge	-1
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	3 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:18:44 UTC 2023` Edited by `admin` on `Sat Dec 16 20:18:44 UTC 2023`
Record UNII	WHS24AJ7HS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isocefalexin sodium

Common Name

English

[6R-[6α,7β(R*)]]-7-[(Aminophenylacetyl)amino]-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid sodium salt

Systematic Name

English

5-Thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid, 7-[(aminophenylacetyl)amino]-3-methylene-8-oxo-, monosodium salt, [6R-[6α,7β(R*)]]-

Systematic Name

English

Cephalexin Related Compound

Common Name

English

Sodium (6R,7R)-7-((R)-2-amino-2-phenylacetamido)-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systematic Name

English

Code System Code Type Description

CAS

37050-97-8

Created by admin on Sat Dec 16 20:18:44 UTC 2023 , Edited by admin on Sat Dec 16 20:18:44 UTC 2023

PRIMARY

FDA UNII

WHS24AJ7HS

Created by admin on Sat Dec 16 20:18:44 UTC 2023 , Edited by admin on Sat Dec 16 20:18:44 UTC 2023

PRIMARY

PUBCHEM

129627286

Created by admin on Sat Dec 16 20:18:44 UTC 2023 , Edited by admin on Sat Dec 16 20:18:44 UTC 2023

PRIMARY

Related Record Type Details


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Isocefalexin

PARENT -> SALT/SOLVATE

Amount: