CHEBI:29688 - telithromycin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name telithromycin
ChEBI ID CHEBI:29688
Stars This entity has been manually annotated by a third party.
Secondary ChEBI IDs CHEBI:46029
Supplier Information
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Formulae C43H65N5O10
C43H65N5O10
Net Charge 0
Average Mass 812.00390
Monoisotopic Mass 811.47314
InChI InChI=1S/C43H65N5O10/c1-12-33-43(8)37(48(41(53)58-43)19-14-13-18-47-23-31(45-24-47)30-16-15-17-44-22-30)27(4)34(49)25(2)21-42(7,54-11)38(28(5)35(50)29(6)39(52)56-33)57-40-36(51)32(46(9)10)20-26(3)55-40/h15-17,22-29,32-33,36-38,40,51H,12-14,18-21H2,1-11H3/t25-,26-,27+,28+,29+,32+,33-,36-,37-,38-,40+,42-,43-/m1/s1
InChIKey LJVAJPDWBABPEJ-MMEUOAQYSA-N
SMILES C[C@@]12[C@](N(C(O1)=O)CCCCN3C=C(N=C3)C=4C=CC=NC4)([C@@H](C)C(=O)[C@H](C)C[C@](OC)(C)[C@@H]([C@H](C([C@](C(O[C@@H]2CC)=O)(C)[H])=O)C)O[C@]5([C@H](O)[C@@H](N(C)C)C[C@H](O5)C)[H])[H]
ChEBI Ontology
Outgoing telithromycin (CHEBI:29688) is a amino sugar (CHEBI:28963)
Synonyms Sources
(3aS,4R,7S,9R,10R,11R,13R,15R,15aR)-4-ethyl-11-methoxy-3a,7,9,11,13,15-hexamethyl-2,6,8,14-tetraoxo-1-[4-(4-pyridin-3-yl-1H-imidazol-1-yl)butyl]tetradecahydro-2H-oxacyclotetradecino[4,3-d][1,3]oxazol-10-yl 3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranoside PDBeChem
HMR 3647 DrugCentral
HMR-3647 KEGG COMPOUND
HMR3647 KEGG COMPOUND
RU 66647 DrugCentral
RU-66647 KEGG COMPOUND
RU66647 KEGG COMPOUND
TELITHROMYCIN PDBeChem
Telithromycin KEGG COMPOUND
Manual Xrefs Databases
2581 DrugCentral
C12009 KEGG COMPOUND
D01078 KEGG DRUG
TEL PDBeChem
View more database links
Registry Number Type Source
191114-48-4 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017