SODIUM 5-METHYL-3-(2-THIENYL)-4-ISOXAZOLYL PENICILLIN MONOHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H16N3O5S2.Na.H2O
Molecular Weight	447.461
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM 5-METHYL-3-(2-THIENYL)-4-ISOXAZOLYL PENICILLIN MONOHYDRATE

Structure Search

SMILES

O.[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(C)ON=C3C4=CC=CS4)C([O-])=O

InChI

InChIKey=WWZNUZNADTXEGH-HWROMZCQSA-M

InChI=1S/C17H17N3O5S2.Na.H2O/c1-7-9(10(19-25-7)8-5-4-6-26-8)13(21)18-11-14(22)20-12(16(23)24)17(2,3)27-15(11)20;;/h4-6,11-12,15H,1-3H3,(H,18,21)(H,23,24);;1H2/q;+1;/p-1/t11-,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	HO
Molecular Weight	17.0073
Charge	-1
Count

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

Molecular Formula	C17H17N3O5S2
Molecular Weight	407.464
Charge	0
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 15:11:27 GMT 2023` Edited by `admin` on `Fri Dec 15 15:11:27 GMT 2023`
Record UNII	6Q6ME25F1P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM 5-METHYL-3-(2-THIENYL)-4-ISOXAZOLYL PENICILLIN MONOHYDRATE

Common Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-6-(((5-METHYL-3-(2-THIENYL)-4-ISOXAZOLYL)CARBONYL)AMINO)-7-OXO-, MONOSODIUM SALT, MONOHYDRATE, (2S-(2.ALPHA.,5.ALPHA.,6.BETA.))-

Systematic Name

English

SODIUM (5-METHYL-3-(2-THIENYL)-4-ISOXAZOLYL)PENICILLANATE MONOHYDRATE

Common Name

English

SODIUM (5-METHYL-3-(2-THIENYL)-4-ISOXAZOLYL)-PENICILLIN MONOHYDRATE

Common Name

English

Code System Code Type Description

FDA UNII

6Q6ME25F1P

Created by admin on Fri Dec 15 15:11:27 GMT 2023 , Edited by admin on Fri Dec 15 15:11:27 GMT 2023

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CAS

23255-06-3

Created by admin on Fri Dec 15 15:11:27 GMT 2023 , Edited by admin on Fri Dec 15 15:11:27 GMT 2023

PRIMARY

PUBCHEM

133082854

Created by admin on Fri Dec 15 15:11:27 GMT 2023 , Edited by admin on Fri Dec 15 15:11:27 GMT 2023

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5-METHYL-3-(2-THIENYL)-4-ISOXAZOLYL PENICILLIN

PARENT -> SALT/SOLVATE

Amount: