UCSF

ZINC03830507

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 26 No

Popular Name: Cephalothin Sodium Cephalothin Sodium

Find On: PubMed — Wikipedia — Google

CAS Numbers: 153-61-7 , 58-71-9 , 58-71-9, 153-61-7 [cephal , 58-71-9, 153-61-7 [cephalothin] , [58-71-9]

Other Names:

(6R,7R)-3-(Acetoxymethyl)-8-oxo-7-(2-(thiophen-2-yl)acetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2

(6R,7R)-3-(Acetoxymethyl)-8-oxo-7-(2-(thiophen-2-yl)acetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-3-(Acetoxymethyl)-8-oxo-7-(2-(thiophen-2-yl)acetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid

(6R,7R)-3-(acetyloxymethyl)-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-3-Acetoxymethyl-8-oxo-7-(2-thiophen-2-yl-acetylamino)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-[(2-thienylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

153-61-7

153-61-7; CET; Cefalotin (BAN); Cefalotina fabra (TN); Cephalothin; D07635

2073-29-2

3-(Acetoxymethyl)-8-oxo-7-(2-(2-thienyl)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid

3-(Hydroxymethyl)-8-oxo-7-(2-(2-thienyl)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid acetate

3-Acetoxymethyl-7-(2-thienylacetamido)-3-cephem-4-carboxylic acid

3-ACETOXYMETHYL-8-OXO-7-(2-THIOPHEN-2-YL-ACETYLAMINO)-5-THIA-1-AZA-BICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID

38253

5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-8-oxo-7-((2-thienylacetyl)amino)-, (6R,7R)-

5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-8-oxo-7-((2-thienylacetyl)amino)-, (6R-trans)-

5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-8-oxo-7-((2-thienylacetyl)amino)-, monosodium salt, (6R,7R)-; 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-8-oxo-7-((2-thienylacetyl)amino)-, mono

5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-(hydroxymethyl)-8-oxo-7-(2-(2-thienyl)acetamido)-, acetate (ester)

5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-[(2-thienylacetyl)amino]-, (6R,7R)-

58-71-9

58-71-9 (mono-hydrochloride salt)

58-71-9; C08100; Cefalotin sodium; Cephalothin sodium

58-71-9; Cephalothin sodium salt; Prestwick_971

58-71-9; CET; Cefalotin sodium (JP16); Cephalothin sodium (USP); D00907; Keflin (TN)

6R-trans-3-((Acetyloxy)methyl)-8-oxo-7-((2-thienylacetyl)amino)-5-thia-1-azabicyclo(4.2.0)-oct-2-ene-2-carboxylic acid

7-(2'-thienylacetamido)cephalosporanic acid; CET

7-(2-(2-Thienyl)acetylamido)cephalosporanic acid

7-(2-Thienylacetamido)cephalosporanic acid

7-(2-Thiopheneacetamido)cephalosporanic acid

7-(Thiophene-2-acetamido)cephalosporanic acid

7-(Thiophene-2-acetamido)cephalosporanic acid sodium

7-(Thiophene-2-acetamido)cephalosporanic acidsodium

7-(Thiophene-2-acetamido)cephalosporin

7beta-(thiophen-2-ylacetamido)-3-acetoxymethyl-3,4-didehydrocepham-4-carboxylic acid

AC1L1LMU

ACETOXYMETHYLOXOTHIOPHENYLACETAMIDOTHIAAZABICYCLOOCTEN

ACETOXYMETHYLOXOTHIOPHENYLACETAMIDOTHIAAZABICYCLOOCTENECARBOXYLICACI

Averon

Averon-1

Averon-1; CPD-9229; Cefalothin; Cefalotin; Cemastin; Cephalothinum; Cephalotin; Coaxin; Keflin; cephalothin

BAN); Cefalotin Sodium (JAN); Cephalothin sodium (FDA

BAN); Cefalotin Sodium (JAN); Cephalothin Sodium (USAN

Bio-0631

BPBio1_001031

BRD-K28210218-236-05-7

BRN 0945586

BSPBio_000937

BSPBio_001963

C07761

C16H16N2O6S2

Cefalothin

Cefalothin;Cefalotina [INN-Spanish];Cefalotine [INN-French];Cefalotinum [INN-Latin];Cephalothin;Cephalothinum;Cephalotin;CLS

Cefalotin

Cefalotin (BAN)

Cefalotin (INN

CEFALOTIN SODIUM

Cefalotin sodium salt

cefalotin(1-)

Cefalotina

Cefalotina fabra

Cefalotina fabra (TN)

Cefalotina [INN-Spanish]

Cefalotine

Cefalotine [INN-French]

Cefalotinum

Cefalotinum [INN-Latin]

Cemastin

Cephalosporin 871

Cephalothin

Cephalothin (sodium)

Cephalothin Monosodium Salt

Cephalothin Sodium (FDA

Cephalothin sodium salt

Cephalothin sodium, Cefalotin sodium

CEPHALOTHIN;7-(2-THIENYLACETAMIDO)CEPHALOSPORANIC

CEPHALOTHIN;7-(2-THIENYLACETAMIDO)CEPHALOSPORANIC ACID

Cephalothinum

Cephalotin

CHEBI:124991

CHEBI:41547; CHEBI:50895

CHEMBL617

CID6024

CLS

Coaxin

D07635

DAP000155

DB00456

DivK1c_000097

EINECS 205-815-7

FDA)

HSDB 3024

IDI1_000097

INN); Cefalotin Sodium (JAN)

KBio1_000097

KBio2_000550

KBio2_003118

KBio2_005686

KBio3_001183

KBioGR_000738

KBioSS_000550

Keflin

LS-150069

LS-187252

MFCD00072025

MFCD00242614

MLS001048966

MolPort-002-515-763

NA

NCGC00159332-02

NINDS_000097

Prestwick0_000719

Prestwick1_000719

Prestwick2_000719

Prestwick3_000719

QA-2510

Seffin

SMR000386987

Sodium (6R,7R)-3-(acetoxymethyl)-8-oxo-7-(2-(thiophen-2-yl)acetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

SPBio_000162

SPBio_002858

Spectrum2_000121

Spectrum3_000332

Spectrum4_000269

Spectrum5_000669

Spectrum_000110

Synclotin

UNII-R72LW146E6

USAN

USP

USP)

USP); Cefalotin (BAN

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 0.57 7.44 -66.19 1 8 -1 116 395.438 7 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 5.21e-02 g/l DrugBank-approved
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Therapy antibacterial SMDC MicroSource
Indications antibiotic KeyOrganics Bioactives
Warnings IRRITANT Matrix Scientific
mechanism Mucopeptide synthesis inhibitor IBScreen Bioactives
biological_use Parenteral antibiotic IBScreen Bioactives

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