loading...| Preferred Name |
telithromycin |
|
| Synonyms |
TELITHROMYCIN Telithromycin (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 HMR 3647 HMR-3647 HMR3647 RU 66647 RU-66647 RU66647 |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_29688 |
|
| charge |
0 |
|
| database_cross_reference |
Drug_Central:2581 KEGG:C12009 PDBeChem:TEL CAS:191114-48-4 KEGG:D01078 |
|
| formula |
C43H65N5O10 |
|
| has_alternative_id |
CHEBI:46029 |
|
| has_exact_synonym |
TELITHROMYCIN Telithromycin |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
(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 HMR 3647 HMR-3647 HMR3647 RU 66647 RU-66647 RU66647 |
|
| id |
CHEBI:29688 |
|
| in_subset | ||
| 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 |
|
| label |
telithromycin |
|
| mass |
812.00390 |
|
| monoisotopicmass |
811.47314 |
|
| notation |
CHEBI:29688 |
|
| prefLabel |
telithromycin |
|
| 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] |
|
| subClassOf |