Compound Summary
Compound Information
carbenicillin
Compound Name: | carbenicillin |
Compound CID: | 20824 |
Synonyms: | carbenicillin Carboxybenzylpenicillin 4697-36-3 alpha-Carboxybenzylpencillin Carbenicilina More... |
Iupac Name: | (2S,5R,6R)-6-[(2-carboxy-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid |
InChI: | InChI=1S/C17H18N2O6S/c1-17(2)11(16(24)25)19-13(21)10(14(19)26-17)18-12(20)9(15(22)23)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,18,20)(H,22,23)(H,24,25)/t9?,10-,11+,14-/m1/s1 |
InChIKey: | FPPNZSSZRUTDAP-UWFZAAFLSA-N |
Canonical Smiles: | CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)O)C(=O)O)C |
Isomeric Smiles: | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)O)C(=O)O)C |
Molecular Weight: | 378.4 |
Molecular Formula: | C17H18N2O6S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
carbenicillin
Molecular Weight: | 378.4 |
Molecular Formula: | C17H18N2O6S |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 7 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 26 |
Complexity: | 645 |
Synonyms
carbenicillin
| carbenicillin | carbenicillin |
|---|---|
carbenicillin |
Carboxybenzylpenicillin |
4697-36-3 |
alpha-Carboxybenzylpencillin |
Carbenicilina |
Carbenicilline |
Carbenicillinum |
Carboxybenzylpenicillin acid |
Pyopen |
CBPC |
Carbenicillina DCIT |
alpha-Phenyl(carboxymethylpenicillin) |
Carbenicilina INN-Spanish |
Carbenicilline INN-French |
Carbenicillinum INN-Latin |
Geopen |
UNII-G42ZU72N5G |
CHEBI:3393 |
C17H18N2O6S |
G42ZU72N5G |
(2S,5R,6R)-6-(2-carboxy-2-phenylacetyl)amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo3.2.0heptane-2-carboxylic acid |
(2S,5R,6R)-6-{carboxy(phenyl)acetylamino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo3.2.0heptane-2-carboxylic acid |
N-(2-carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)hept-6-yl)-2-phenylmalonamic acid |
Carbenicillina |
BRL-2064 |
Carbenicillin INN:BAN |
(2S,5R,6R)-6-(2-carboxy-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo3.2.0heptane-2-carboxylic acid |
Carbenicillin (INN) |
HSDB 3020 |
EINECS 225-171-0 |
6-(alpha-Carboxyphenylacetamido)penicillanic acid |
CP 15639-2 |
CP-15-639-2 |
NSC111071 |
(2S,5R,6R)-6-(3-hydroxy-3-oxo-2-phenyl-propanoyl)amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo3.2.0heptane-2-carboxylic acid |
N-(2-Carboxy-3,3-dimethyl-7-oxo-4-thia-azabicyclo(3.2.0)hept-6-yl)-2-phenylmalonamic acid |
Spectrum_000098 |
Spectrum2_000120 |
Spectrum3_000326 |
Spectrum4_000263 |
Spectrum5_000900 |
Epitope ID:116648 |
SCHEMBL3375 |
CHEMBL1214 |
BSPBio_001931 |
KBioGR_000726 |
KBioSS_000518 |
4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((carboxyphenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2alpha,5alpha,6beta))- |
Malonamic acid, N-(2-carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)hept-6-yl)-2-phenyl- |
DivK1c_000735 |
SPBio_000140 |
DTXSID6048464 |
GTPL10768 |
KBio1_000735 |
KBio2_000518 |
KBio2_003086 |
KBio2_005654 |
KBio3_001151 |
BRL2064 |
NINDS_000735 |
BCP28512 |
HY-B0525 |
3523AH |
6beta-(2-carboxy-2-phenylacetamido)-2,2-dimethylpenam-3alpha-carboxylic acid |
DB00578 |
IDI1_000735 |
SBI-0051303.P003 |
CP-156392 |
C06869 |
D07614 |
Klebsiella Selective Supplement, for microbiology |
Q1050019 |
Carbenicillin, Ready Made Solution, 100 mg/mL in ethanol/water, 0.2 mum filtered |
4-Thia-1-azabicyclo3.2.0heptane-2-carboxylic acid, 6-(carboxyphenylacetyl)amino-3,3-dimethyl-7-oxo-, (2S,5R,6R)- |
Experimental Data
carbenicillin
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 6 | ug/mL | 18.1 | 22.7 | 15.8 | Unclear | 23698443 |
Experimental Data Visualization
carbenicillin
Statistics Data
carbenicillin
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 15.8 | 1 | 1 |
Statistics Data Visualization
carbenicillin
