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CHEBI:752006 - efrotomycin

Default Structure
ChEBI IDCHEBI:752006
ChEBI Nameefrotomycin
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC59H88N2O20
Net Charge0
Average Mass1145.347
Monoisotopic Mass1144.59304
SMILES[H][C@@]1([C@H](C)[C@H](OC)/C(C)=C/C=C/CNC(=O)[C@@H](CC)[C@@]2(O)O[C@@H](/C=C/C=C/C)C(C)(C)[C@@H](O[C@@H]3O[C@H](C)[C@@H](O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](O)[C@H]4OC)[C@@H](OC)[C@H]3O)[C@H]2O)O[C@H](/C=C/C=C/C=C(\C)C(=O)c2c(O)ccn(C)c2=O)[C@H](O)[C@@H]1O
InChIInChI=1S/C59H88N2O20/c1-15-17-19-27-39-58(8,9)53(80-56-45(67)50(74-13)49(35(7)76-56)79-57-51(75-14)44(66)48(73-12)34(6)77-57)52(68)59(71,81-39)36(16-2)54(69)60-29-23-22-25-32(4)46(72-11)33(5)47-43(65)42(64)38(78-47)26-21-18-20-24-31(3)41(63)40-37(62)28-30-61(10)55(40)70/h15,17-28,30,33-36,38-39,42-53,56-57,62,64-68,71H,16,29H2,1-14H3,(H,60,69)/b17-15+,20-18+,23-22+,26-21+,27-19+,31-24+,32-25+/t33-,34+,35-,36-,38-,39+,42+,43+,44-,45-,46-,47+,48+,49-,50+,51-,52-,53+,56+,57+,59-/m1/s1
InChIKeyASOJLQIBBYOFDE-HCHBIZCOSA-N
ChEBI Ontology
Outgoing Relation(s)
efrotomycin (CHEBI:752006) is a chloropyridine (CHEBI:39173)
INNs  Source
efrotomicinaWHO MedNet
efrotomycineWHO MedNet
Synonyms  Source
EfrotomycinChEMBL
MK-621ChEMBL
ProducilChEMBL