MCB-3681

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H32F2N4O8
Molecular Weight	626.6046
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(F)=C(OCC3(O)CCN(CC3)C4=CC5=C(C=C4F)C(=O)C(=CN5C6CC6)C(O)=O)C=C2

InChI

InChIKey=YEDRNPDLVCNIAV-FQEVSTJZSA-N

InChI=1S/C31H32F2N4O8/c1-17(38)34-13-20-14-37(30(42)45-20)19-4-5-27(24(33)10-19)44-16-31(43)6-8-35(9-7-31)26-12-25-21(11-23(26)32)28(39)22(29(40)41)15-36(25)18-2-3-18/h4-5,10-12,15,18,20,43H,2-3,6-9,13-14,16H2,1H3,(H,34,38)(H,40,41)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H32F2N4O8
Molecular Weight	626.6046
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 `Tue Apr 01 16:31:34 GMT 2025` Edited by `admin` on `Tue Apr 01 16:31:34 GMT 2025`
Record UNII	6BMP8F2J00
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-QUINOLINECARBOXYLIC ACID, 7-(4-((4-((5S)-5-((ACETYLAMINO)METHYL)-2-OXO-3-OXAZOLIDINYL)-2-FLUOROPHENOXY)METHYL)-4-HYDROXY-1-PIPERIDINYL)-1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-4-OXO-

Preferred Name

English

MCB-3681

Common Name

English

7-(4-((4-((5S)-5-(ACETAMIDOMETHYL)-2-OXO-OXAZOLIDIN-3-YL)-2-FLUORO-PHENOXY)METHYL)-4-HYDROXY-1-PIPERIDYL)-1-CYCLOPROPYL-6-FLUORO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

6BMP8F2J00

Created by admin on Tue Apr 01 16:31:35 GMT 2025 , Edited by admin on Tue Apr 01 16:31:35 GMT 2025

PRIMARY

PUBCHEM

11273606

Created by admin on Tue Apr 01 16:31:35 GMT 2025 , Edited by admin on Tue Apr 01 16:31:35 GMT 2025

PRIMARY

CAS

790704-42-6

Created by admin on Tue Apr 01 16:31:35 GMT 2025 , Edited by admin on Tue Apr 01 16:31:35 GMT 2025

PRIMARY

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					1221R21ZRQ

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PRODRUG -> METABOLITE ACTIVE

Comments:

An essential process in the discovery on new antiinfective agents is the demonstration of the efficacy in an animal model. On the poster presented here, MCB3837, a water soluble prodrug of MCB3681, is shown to be active in two different mouse models. The first of these, the peritonitis model, is designed to demonstrate the correlation between activity in the test tube and the effect in the animal. This model is useful for determining the initial data as to the relationship between an effect and the amount (i.e. the dose) of the antibiotic required to produce it. It could be shown that MCB3837 showed a dose related effect similar to the two well known antibiotics, penicillin and erythromycin, in this model.

Related Record Type Details


					6BMP8F2J00

MCB-3681

ACTIVE MOIETY