5'-HYDROXYMETHYL DICLOXACILLIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H17Cl2N3O6S
Molecular Weight	486.326
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5'-HYDROXYMETHYL DICLOXACILLIN

Structure Search

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(CO)ON=C3C4=C(Cl)C=CC=C4Cl)C(O)=O

InChI

InChIKey=BKFXQQUYRJTASJ-JKIFEVAISA-N

InChI=1S/C19H17Cl2N3O6S/c1-19(2)14(18(28)29)24-16(27)13(17(24)31-19)22-15(26)11-9(6-25)30-23-12(11)10-7(20)4-3-5-8(10)21/h3-5,13-14,17,25H,6H2,1-2H3,(H,22,26)(H,28,29)/t13-,14+,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H17Cl2N3O6S
Molecular Weight	486.326
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 `Sat Dec 16 15:04:38 UTC 2023` Edited by `admin` on `Sat Dec 16 15:04:38 UTC 2023`
Record UNII	4RR998PRE6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5'-HYDROXYMETHYL DICLOXACILLIN

Common Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(((3-(2,6-DICHLOROPHENYL)-5-(HYDROXYMETHYL)-4-ISOXAZOLYL)CARBONYL)AMINO)-3,3-DIMETHYL-7-OXO-, (2S,5R,6R)-

Common Name

English

(2S,5R,6R)-6-(((3-(2,6-DICHLOROPHENYL)-5-(HYDROXYMETHYL)-4-ISOXAZOLYL)CARBONYL)AMINO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID

Systematic Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(((3-(2,6-DICHLOROPHENYL)-5-(HYDROXYMETHYL)-4-ISOXAZOLYL)CARBONYL)AMINO)-3,3-DIMETHYL-7-OXO-, (2S-(2.ALPHA.,5.ALPHA.,6.BETA.))-

Systematic Name

English

Code System Code Type Description

CAS

40125-80-2

Created by admin on Sat Dec 16 15:04:38 UTC 2023 , Edited by admin on Sat Dec 16 15:04:38 UTC 2023

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PUBCHEM

134687289

Created by admin on Sat Dec 16 15:04:38 UTC 2023 , Edited by admin on Sat Dec 16 15:04:38 UTC 2023

PRIMARY

FDA UNII

4RR998PRE6

Created by admin on Sat Dec 16 15:04:38 UTC 2023 , Edited by admin on Sat Dec 16 15:04:38 UTC 2023

PRIMARY

Related Record Type Details


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DICLOXACILLIN

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