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CHEBI:32235 - Tobicillin

ChEBI IDCHEBI:32235
ChEBI NameTobicillin
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC27H30N2O6S
Net Charge0
Average Mass510.612
Monoisotopic Mass510.18246
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)Oc3cccc(COC(=O)C(C)C)c3)N1C(=O)[C@H]2NC(=O)Cc1ccccc1
InChIInChI=1S/C27H30N2O6S/c1-16(2)25(32)34-15-18-11-8-12-19(13-18)35-26(33)22-27(3,4)36-24-21(23(31)29(22)24)28-20(30)14-17-9-6-5-7-10-17/h5-13,16,21-22,24H,14-15H2,1-4H3,(H,28,30)/t21-,22+,24-/m1/s1
InChIKeyMGKUHWMKIYHWOJ-AOHZBQACSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
Tobicillin (CHEBI:32235) is a penicillin (CHEBI:17334)
Synonym  Source
TobicillinKEGG COMPOUND
Manual XrefsDatabases
D01214KEGG DRUG
Registry NumbersSources
CAS:151287-22-8KEGG COMPOUND