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CHEBI:754475 - penethamate

Default Structure
ChEBI IDCHEBI:754475
ChEBI Namepenethamate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC22H31N3O4S
Net Charge0
Average Mass433.574
Monoisotopic Mass433.20353
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)OCCN(CC)CC)N1C(=O)[C@H]2NC(=O)Cc1ccccc1
InChIInChI=1S/C22H31N3O4S/c1-5-24(6-2)12-13-29-21(28)18-22(3,4)30-20-17(19(27)25(18)20)23-16(26)14-15-10-8-7-9-11-15/h7-11,17-18,20H,5-6,12-14H2,1-4H3,(H,23,26)/t17-,18+,20-/m1/s1
InChIKeyAFKRZUUZFWTBCC-WSTZPKSXSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
penethamate (CHEBI:754475) is a peptide (CHEBI:16670)
Synonyms  Source
EphicillinChEMBL
PenethamateChEMBL