CHEBI:145339 - erythromycin-[N-methyl-14C]

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ChEBI Name erythromycin-[N-methyl-14C]
ChEBI ID CHEBI:145339
ChEBI ASCII Name erythromycin-[N-methyl-(14)C]
Definition A 14C-modified compound that is erythromycin A in which one of the methyl groups of the dimethylnitrilo group has a 14C label. It is used in a breath test to detect liver cytochrome P450 enzyme (CYP3A4) activity in humans.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C36[14C]H67NO13
Net Charge 0
Average Mass 735.929
Monoisotopic Mass 735.46448
InChI InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1/i11+2
InChIKey ULGZDMOVFRHVEP-RFAHSBMDSA-N
SMILES [C@H]1(O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N([14CH3])C)O)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]([C@H](OC([C@@H]([C@H]([C@@H]1C)O[C@H]3C[C@]([C@H]([C@@H](O3)C)O)(OC)C)C)=O)CC)(C)O)O
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
(via erythromycin )
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
(via erythromycin )
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.
(via erythromycin )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via macrolide antibiotic )
Application(s): probe
A role played by a molecular entity used to study the microscopic environment.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing erythromycin-[N-methyl-14C] (CHEBI:145339) has role probe (CHEBI:50406)
erythromycin-[N-methyl-14C] (CHEBI:145339) is a 14C-modified compound (CHEBI:139542)
erythromycin-[N-methyl-14C] (CHEBI:145339) is a cyclic ketone (CHEBI:3992)
erythromycin-[N-methyl-14C] (CHEBI:145339) is a erythromycin (CHEBI:48923)
IUPAC Name
(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-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-[methyl((114C)methyl)amino]oxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
Synonyms Sources
14C-N-methyl-erythromycin ChEBI
[14C-N-methyl]-erythromycin ChEBI
[N-methyl-14C]-erythromycin ChEBI
[N-methyl-14C]erythromycin ChEBI
erythromycin N-methyl C-14 ChemIDplus
Registry Number Type Source
92530-59-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
12803574 PubMed citation Europe PMC
15200453 PubMed citation Europe PMC
15270556 PubMed citation Europe PMC
15679319 PubMed citation Europe PMC
16842395 PubMed citation Europe PMC
21626050 PubMed citation Europe PMC
2526615 PubMed citation Europe PMC
9566442 PubMed citation Europe PMC
9650537 PubMed citation Europe PMC
Last Modified
12 November 2019