Ledaborbactam

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H14BNO5
Molecular Weight	263.054
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ledaborbactam

Structure Search

SMILES

CCC(=O)N[C@H]1CC2=CC=CC(C(O)=O)=C2OB1O

InChI

InChIKey=QAGGLFCWUVSERJ-VIFPVBQESA-N

InChI=1S/C12H14BNO5/c1-2-10(15)14-9-6-7-4-3-5-8(12(16)17)11(7)19-13(9)18/h3-5,9,18H,2,6H2,1H3,(H,14,15)(H,16,17)/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C12H14BNO5
Molecular Weight	263.054
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 00:36:35 GMT 2025` Edited by `admin` on `Wed Apr 02 00:36:35 GMT 2025`
Record UNII	G2WGD69BLI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Ledaborbactam

Official Name

English

VNRX-5236

Preferred Name

English

2H-1,2-Benzoxaborin-8-carboxylic acid, 3,4-dihydro-2-hydroxy-3-[(1-oxopropyl)amino]-, (3R)-

Systematic Name

English

ledaborbactam [INN]

Common Name

English

VNRX-7145 ACTIVE METABOLITE

Code

English

VNRX-7145 ACID

Code

English

(3R)-2-hydroxy-3-(propanamido)-3,4-dihydro-2H-1,2-benzoxaborinine-8-carboxylic acid

Systematic Name

English

LEDABORBACTAM [USAN]

Common Name

English

Code System Code Type Description

NCI_THESAURUS

C184846

Created by admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025

PRIMARY

CAS

1842397-36-7

Created by admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025

PRIMARY

INN

11708

Created by admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025

PRIMARY

USAN

KL-195

Created by admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025

PRIMARY

SMS_ID

300000039039

Created by admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025

PRIMARY

FDA UNII

G2WGD69BLI

Created by admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025

PRIMARY

PUBCHEM

138455079

Created by admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025

PRIMARY

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