UCSF

ZINC03871967

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 27 No

Popular Name: Ceftibuten Ceftibuten

Find On: PubMed — Wikipedia — Google

CAS Numbers: 118081-34-8 , 97519-39-6 , [118081-34-8]

Other Names:

(+)-(6R,7R)-7-((Z)-2-(2-Amino-4-thiazolyl)-4-carboxycrotonamido)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid

(+)-(6R,7R)-7-((Z)-2-(2-amino-4-thiazolyl)-4-carboxycrotonamido)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid; cis-ceftibuten

(6R,7R)-7-[[(E)-2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-7-[[(Z)-2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-7-[[(Z)-2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid dihydrate; ceftibuten; ceftibuten dihydrate; ceftibuten.2H2O

(6R,7R)-7-[[2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxybut-2-enoyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

118081-34-8; CETB; Cedax (TN); Ceftibuten hydrate (JP16); D02121; Seftem (TN)

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-(6-alpha,7-beta(Z)))-

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-(6alpha,7beta(Z)))-

7-[[(E)-2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

7-[[(Z)-2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

7-[[2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

7432-S

7432-S; SCH-39720

7beta-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxybut-2-enoyl]amino}-3,4-didehydrocepham-4-carboxylic acid

97519-39-6

97519-39-6; C08117; Ceftibuten

97519-40-9

AC1L1E5W

AC1L44AE

AC1NQY0W

AC1NQZPP

AC1O44MA

AC1O4QO4

AKOS005146205

Antibiotic 7432S

BIDD:GT0855

BSPBio_002733

C08117

C15H14N4O6S2

Cedax

cef-

Ceftem

Ceftibuten (BAN

Ceftibuten (USAN/INN)

Ceftibuten 2-hydrate

Ceftibuten dihydrate

Ceftibuten Dihydrate (FDA); Ceftibuten (BAN

Ceftibuten hydrate

Ceftibuten [USAN:INN:BAN]

ceftibuten; ceftibutene; ceftibuteno; ceftibutenum

Ceftibutendihydrate

Ceftibutene

Ceftibutene [INN-French]

Ceftibuteno

Ceftibuteno [INN-Spanish]

Ceftibutenum

Ceftibutenum [INN-Latin]

Cephalosporin 7432-S

Cephem

Ceprifran

CETB

CHEBI:3510

CHEBI:554578

CHEMBL1605

CID178967

CID2654

CID5281102

CID5282242

CID6375005

CID6398762

cis-ceftibuten

cis-Ceftibutin

D00922

DAP000456

DB01415

HMS1922L17

HMS2093K18

INN

Isocef

KBio2_002285

KBio2_004853

KBio2_007421

KBio3_001953

KBioGR_001649

KBioSS_002287

Keimax

LS-149976

LS-187379

MFCD00864918

MFCD08141796

MolPort-003-666-607

NCGC00095137-01

NCGC00095137-02

NCGC00178501-01

S 7432

Sch 39720

SCH-39720

SPBio_001608

SPECTRUM1505207

Spectrum2_001684

Spectrum3_001007

Spectrum4_001135

Spectrum5_001558

Spectrum_001794

trans-Ceftibuten

UNII-IW71N46B4Y

USAN)

USAN); Ceftibuten Dihydrate (FDA)

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.00 4.89 -115.45 3 10 -2 169 408.417 6 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 7.05e-02 g/l DrugBank-approved
Therapy antibacterial SMDC Pharmakon

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )