CHEBI:48935 - (E)-roxithromycin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (E)-roxithromycin
ChEBI ASCII Name (E)-roxithromycin
Definition A major geometrical isomer of roxithromycin.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:45437, CHEBI:48846
Supplier Information
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Formula C41H76N2O15
Net Charge 0
Average Mass 837.04662
Monoisotopic Mass 836.52457
InChI InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/b42-31+/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1
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]2O)N(C)C)[C@](C)(O)C[C@@H](C)\C(=N/OCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
antibacterial drug
A drug used to treat or prevent bacterial infections.
(via roxithromycin )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via macrolide antibiotic )
Application(s): antibacterial drug
A drug used to treat or prevent bacterial infections.
(via roxithromycin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (E)-roxithromycin (CHEBI:48935) has role environmental contaminant (CHEBI:78298)
(E)-roxithromycin (CHEBI:48935) has role xenobiotic (CHEBI:35703)
(E)-roxithromycin (CHEBI:48935) is a roxithromycin (CHEBI:48844)
INNs Sources
roxithromycin ChemIDplus
roxithromycine ChemIDplus
roxithromycinum ChemIDplus
roxitromicina ChemIDplus
Synonyms Sources
(9E)-erythromycin 9-(O-((2-methoxyethoxy)methyl)oxime) ChemIDplus
Manual Xrefs Databases
2410 DrugCentral
HMDB0014916 HMDB
View more database links
Registry Numbers Types Sources
5900029 Beilstein Registry Number Beilstein
5900029 Reaxys Registry Number Reaxys
80214-83-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
12575424 PubMed citation Europe PMC
24462419 PubMed citation Europe PMC
Last Modified
22 February 2017