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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H33F2N4O11P
Molecular Weight 706.5845
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MCB-3837

SMILES

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

InChI

InChIKey=MNABRWLVTSGIMU-FQEVSTJZSA-N
InChI=1S/C31H33F2N4O11P/c1-17(38)34-13-20-14-37(30(42)47-20)19-4-5-27(24(33)10-19)46-16-31(48-49(43,44)45)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/h4-5,10-12,15,18,20H,2-3,6-9,13-14,16H2,1H3,(H,34,38)(H,40,41)(H2,43,44,45)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C31H33F2N4O11P
Molecular Weight 706.5845
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 17:17:57 GMT 2025
Edited
by admin
on Tue Apr 01 17:17:57 GMT 2025
Record UNII
1221R21ZRQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MCB-3837
Common Name English
MCB 3837
Preferred Name English
7-(4-((4-((5S)-5-(ACETAMIDOMETHYL)-2-OXO-OXAZOLIDIN-3-YL)-2-FLUORO-PHENOXY)METHYL)-4-PHOSPHONOOXY-1-PIPERIDYL)-1-CYCLOPROPYL-6-FLUORO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID
Systematic Name English
3-QUINOLINECARBOXYLIC ACID, 7-(4-((4-((5S)-5-((ACETYLAMINO)METHYL)-2-OXO-3-OXAZOLIDINYL)-2-FLUOROPHENOXY)METHYL)-4-(PHOSPHONOOXY)-1-PIPERIDINYL)-1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-4-OXO-
Systematic Name English
OXAQUIN
Common Name English
Code System Code Type Description
FDA UNII
1221R21ZRQ
Created by admin on Tue Apr 01 17:17:57 GMT 2025 , Edited by admin on Tue Apr 01 17:17:57 GMT 2025
PRIMARY
NCI_THESAURUS
C173413
Created by admin on Tue Apr 01 17:17:57 GMT 2025 , Edited by admin on Tue Apr 01 17:17:57 GMT 2025
PRIMARY
CAS
790704-50-6
Created by admin on Tue Apr 01 17:17:57 GMT 2025 , Edited by admin on Tue Apr 01 17:17:57 GMT 2025
PRIMARY
PUBCHEM
44201350
Created by admin on Tue Apr 01 17:17:57 GMT 2025 , Edited by admin on Tue Apr 01 17:17:57 GMT 2025
PRIMARY
SMS_ID
300000040809
Created by admin on Tue Apr 01 17:17:57 GMT 2025 , Edited by admin on Tue Apr 01 17:17:57 GMT 2025
PRIMARY
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