trans-Ceftibuten

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H14N4O6S2
Molecular Weight	410.425
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12SCC=C(N1C(=O)[C@H]2NC(=O)C(=C\CC(O)=O)\C3=CSC(N)=N3)C(O)=O

InChI

InChIKey=UNJFKXSSGBWRBZ-VTSZRNMSSA-N

InChI=1S/C15H14N4O6S2/c16-15-17-7(5-27-15)6(1-2-9(20)21)11(22)18-10-12(23)19-8(14(24)25)3-4-26-13(10)19/h1,3,5,10,13H,2,4H2,(H2,16,17)(H,18,22)(H,20,21)(H,24,25)/b6-1+/t10-,13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H14N4O6S2
Molecular Weight	410.425
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:36:39 GMT 2023` Edited by `admin` on `Sat Dec 16 19:36:39 GMT 2023`
Record UNII	4DS5YK8DR8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

trans-Ceftibuten

Common Name

English

5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[2-(2-amino-4-thiazolyl)-4-carboxy-1-oxo-2-butenyl]amino]-8-oxo-, [6R-[6α,7β(E)]]-

Systematic Name

English

5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2E)-2-(2-amino-4-thiazolyl)-4-carboxy-1-oxo-2-butenyl]amino]-8-oxo-, (6R,7R)-

Systematic Name

English

5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2E)-2-(2-amino-4-thiazolyl)-4-carboxy-1-oxo-2-buten-1-yl]amino]-8-oxo-, (6R,7R)-

Systematic Name

English

(6R,7R)-7-[[(2E)-2-(2-Amino-4-thiazolyl)-4-carboxy-1-oxo-2-buten-1-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systematic Name

English

Code System Code Type Description

CAS

97519-40-9

Created by admin on Sat Dec 16 19:36:39 GMT 2023 , Edited by admin on Sat Dec 16 19:36:39 GMT 2023

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FDA UNII

4DS5YK8DR8

Created by admin on Sat Dec 16 19:36:39 GMT 2023 , Edited by admin on Sat Dec 16 19:36:39 GMT 2023

PRIMARY

PUBCHEM

6398762

Created by admin on Sat Dec 16 19:36:39 GMT 2023 , Edited by admin on Sat Dec 16 19:36:39 GMT 2023

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