CHEBI:48913 - erythromycin A 2'-propanoate

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ChEBI Name erythromycin A 2'-propanoate
ChEBI ID CHEBI:48913
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C40H71NO14
Net Charge 0
Average Mass 789.99008
Monoisotopic Mass 789.48746
InChI InChI=1S/C40H71NO14/c1-15-27-40(11,48)33(44)22(5)30(43)20(3)18-38(9,47)35(55-37-32(53-28(42)16-2)26(41(12)13)17-21(4)50-37)23(6)31(24(7)36(46)52-27)54-29-19-39(10,49-14)34(45)25(8)51-29/h20-27,29,31-35,37,44-45,47-48H,15-19H2,1-14H3/t20-,21-,22+,23+,24-,25+,26+,27-,29+,31+,32-,33-,34+,35-,37+,38-,39-,40-/m1/s1
InChIKey TYQXKHPOXXXCTP-CSLYCKPJSA-N
SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2OC(=O)CC)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via macrolide antibiotic )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing erythromycin A 2'-propanoate (CHEBI:48913) has functional parent erythromycin A (CHEBI:42355)
erythromycin A 2'-propanoate (CHEBI:48913) is a erythromycin derivative (CHEBI:48924)
Incoming erythromycin estolate (CHEBI:4846) has part erythromycin A 2'-propanoate (CHEBI:48913)
IUPAC Name
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-(2,6-dideoxy-3-C-methyl-3-O-methyl-α-L-ribo-hexopyranosyloxy)-14-ethyl-7,12,13-trihydroxy-6-[3,4,6-trideoxy-3-(dimethylamino)-2-O-propanoyl-β-D-xylo-hexopyranosyloxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione
Synonyms Sources
erythromycin 2'-propanoate ChemIDplus
erythromycin 2'-propionate ChemIDplus
erythromycin propionate ChemIDplus
propionylerythromycin ChemIDplus
Manual Xrefs Databases
1052 DrugCentral
LSM-2876 LINCS
View more database links
Registry Numbers Types Sources
134-36-1 CAS Registry Number ChemIDplus
76686 Beilstein Registry Number Beilstein
Last Modified
22 February 2017