Sodium (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2S)-oxolan-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H14NO5S.Na
Molecular Weight	307.298
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Sodium (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2S)-oxolan-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Structure Search

SMILES

[Na+].C[C@@H](O)[C@@H]1[C@H]2SC([C@@H]3CCCO3)=C(N2C1=O)C([O-])=O

InChI

InChIKey=ICSAXRANXQSPQP-RJTYULJWSA-M

InChI=1S/C12H15NO5S.Na/c1-5(14)7-10(15)13-8(12(16)17)9(19-11(7)13)6-3-2-4-18-6;/h5-7,11,14H,2-4H2,1H3,(H,16,17);/q;+1/p-1/t5-,6+,7+,11-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C12H14NO5S
Molecular Weight	284.308
Charge	-1
Count

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

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:20:54 GMT 2025` Edited by `admin` on `Wed Apr 02 17:20:54 GMT 2025`
Record UNII	K9STE27Z77
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Faropenem Impurity Sodium Salt

Preferred Name

English

Sodium (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2S)-oxolan-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systematic Name

English

4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2S)-tetrahydro-2-furanyl]-, sodium salt, (5R,6S)-

Systematic Name

English

4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 6-(1-hydroxyethyl)-7-oxo-3-(tetrahydro-2-furanyl)-, monosodium salt, [5R-[3(S*),5?,6?(R*)]]-

Systematic Name

English

Code System Code Type Description

PUBCHEM

162313496

Created by admin on Wed Apr 02 17:20:54 GMT 2025 , Edited by admin on Wed Apr 02 17:20:54 GMT 2025

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FDA UNII

K9STE27Z77

Created by admin on Wed Apr 02 17:20:54 GMT 2025 , Edited by admin on Wed Apr 02 17:20:54 GMT 2025

PRIMARY

CAS

195716-77-9

Created by admin on Wed Apr 02 17:20:54 GMT 2025 , Edited by admin on Wed Apr 02 17:20:54 GMT 2025

PRIMARY

Related Record Type Details


					89JG8Q48PF

(5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2S)-oxolan-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

PARENT -> SALT/SOLVATE

Amount: