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CHEBI:31555 - erythromycin ethylsuccinate

ChEBI IDCHEBI:31555
ChEBI Nameerythromycin ethylsuccinate
Stars
DefinitionA erythromycin derivative that is erythromycin A in which the hydroxy group at position 3R is substituted by a (4-ethoxy-4-oxobutanoyl)oxy group. It is used for the treatment of a wide variety of bacterial infections.
Last Modified12 October 2021
DownloadsMolfile
FormulaC43H75NO16
Net Charge0
Average Mass862.064
Monoisotopic Mass861.50859
SMILESCCOC(=O)CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C
InChIInChI=1S/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32+,34+,35-,36-,37+,38-,40+,41-,42-,43-/m1/s1
InChIKeyNSYZCCDSJNWWJL-YXOIYICCSA-N
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
erythromycin ethylsuccinate (CHEBI:31555) has functional parent erythromycin A (CHEBI:42355)
erythromycin ethylsuccinate (CHEBI:31555) is a cyclic ketone (CHEBI:3992)
erythromycin ethylsuccinate (CHEBI:31555) is a erythromycin derivative (CHEBI:48924)
erythromycin ethylsuccinate (CHEBI:31555) is a ethyl ester (CHEBI:23990)
erythromycin ethylsuccinate (CHEBI:31555) is a succinate ester (CHEBI:36181)
IUPAC Name 
(2S,3R,4S,6R)-4-(dimethylamino)-2-{[(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-{[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl]oxy}-3,5,7,9,11,13-hexamethyl-2,10-dioxo-1-oxacyclotetradecan-6-yl]oxy}-6-methyltetrahydro-2H-pyran-3-yl ethyl butanedioate
Synonyms  Source
erythromycin ethylsuccinateChemIDplus
erythromycin ethyl succinateChemIDplus
erythrocin ethyl succinateChemIDplus
erythromycin 2'-(ethyl succinate)ChemIDplus
erythromycin 2'-(ethyl butanedioate)ChemIDplus
erythromycin mono(ethyl succinate)ChemIDplus
Brand Names  Source
E-MycinChemIDplus
E-Mycin EChemIDplus
EESChemIDplus
E.E.S 400ChemIDplus
E.E.S 200ChemIDplus
E.E.SChemIDplus
Manual XrefsDatabases
C12796KEGG COMPOUND
D01361KEGG DRUG
LSM-3144LINCS
1051DrugCentral
LMPK05000001LIPID MAPS
CN1602887Patent
Registry NumbersSources
Reaxys:77638Reaxys
CAS:1264-62-6ChemIDplus
Citations