Ticillin
Properties
- Molecular formula
- C15H14N2Na2O6S2
- Molar mass
- 428.38 g/mol
- Exact mass
- 428.0089 Da
- logP
- 0.63Crippen estimate
- Polar surface area
- 127.5 Ų
- H-bond donors / acceptors
- 3 / 6
- Rotatable bonds
- 5
- Stereocentres
- R, R, Sin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
4697-14-7SMILES
CC1(C)S[C@@H]2[C@H](NC(=O)C(C([O-])=O)c3ccsc3)C(=O)N2[C@H]1C([O-])=O.[Na+].[Na+]InChI
The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.
Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[2-carboxy-2-(3-thienyl)acetyl]amino]-3,3-dimethyl-7-oxo-, sodium salt (1:2), (2S,5R,6R)-
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(carboxy-3-thienylacetyl)amino]-3,3-dimethyl-7-oxo-, disodium salt, [2S-(2α,5α,6β)]-
- 3-Thiophenemalonamic acid, N-(2-carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-6-yl)-, disodium salt
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(carboxy-3-thienylacetyl)amino]-3,3-dimethyl-7-oxo-, disodium salt, (2S,5R,6R)-
- Aerugipen
Work with Ticillin
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Carbenicillin disodium4800-94-677 % similar
Ampicillin sodium69-52-364 % similar
Sulbenicillin sodium28002-18-861 % similar
Amoxicillin sodium34642-77-861 % similar
Penicillin G sodium69-57-857 % similar
Azlocillin sodium37091-65-956 % similar
Methicillin sodium132-92-354 % similar
Piperacillin sodium59703-84-352 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.