loading...| Preferred Name |
telavancin |
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| Synonyms |
C80H107Cl3N11O27P Td 6424 C80H106C12N11O27P.(HCl)n Vibativ (1S,2R,18R,19R,22S,25R,28R,40S)-22-(carbamoylmethyl)-5,15-dichloro-48-{[(2S,3R,4S,5S,6R)-3-{[(2S,4S,5S,6S)-4-{[2-(decylamino)ethyl]amino}-5-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,18,32,35,37-pentahydroxy-19-[(2R)-4-methyl-2-(methylamino)pentanamido]-20,23,26,42,44-pentaoxo-36-{[(phosphonomethyl)amino]methyl}-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.2?,?.2??,??.1?,??.1??,??.0??,??.0??,??]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34(39),35,37,46,49-pentadecaene-40-carboxylic acid hydrochloride telavancin hydrochloride Td-6424 |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_71226 |
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| AHFScode |
8:12.28.16 |
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| ATCCode |
J01XA03 |
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| DBBrand |
vibativ |
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| DBSalt |
telavancin hydrochloride |
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| DBSynonym |
td-6424 |
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| Definition |
Telavancin is a semi-synthetic derivative of vanocymycin that has bactericidal activity against Methicillin-resistant Staphylococcus aureus (MRSA is an important pathogen causing hospital-acquired pneumonia (HAP) worldwide) and other gram-positive bacteria. FDA approved on September 11, 2009. A hydrochloride obtained by combining telavancin and hydrochloric acid. The composition of the compound is telavancin.nHCl where n = 1-3. Used for treatment of adults with complicated skin and skin structure infections caused by bacteria. |
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| has role | ||
| InChI |
InChI=1S/C80H106Cl2N11O27P.ClH/c1-7-8-9-10-11-12-13-14-21-85-22-23-87-80(5)32-57(115-37(4)71(80)103)119-70-68(102)67(101)55(34-94)118-79(70)120-69-53-28-41-29-54(69)117-52-20-17-40(27-46(52)82)65(99)63-77(109)91-61(78(110)111)43-30-50(96)44(33-86-35-121(112,113)114)66(100)58(43)42-25-38(15-18-49(42)95)59(74(106)93-63)90-75(107)60(41)89-73(105)48(31-56(83)97)88-76(108)62(92-72(104)47(84-6)24-36(2)3)64(98)39-16-19-51(116-53)45(81)26-39;/h15-20,25-30,36-37,47-48,55,57,59-65,67-68,70-71,79,84-87,94-96,98-103H,7-14,21-24,31-35H2,1-6H3,(H2,83,97)(H,88,108)(H,89,105)(H,90,107)(H,91,109)(H,92,104)(H,93,106)(H,110,111)(H2,112,113,114);1H/t37-,47+,48-,55+,57-,59+,60+,61-,62+,63-,64+,65+,67+,68-,70+,71+,79-,80-;/m0./s1 |
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| InChIKey |
InChIKey=GSSIWSIRBWAZHG-ACOPVEIWSA-N |
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| label |
telavancin telavancin hydrochloride |
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| may interact with |
http://purl.obolibrary.org/obo/CHEBI_8212 http://purl.obolibrary.org/obo/CHEBI_156095 http://purl.obolibrary.org/obo/CHEBI_63622 http://purl.obolibrary.org/obo/dinto_DB00342 http://purl.obolibrary.org/obo/CHEBI_45081 http://purl.obolibrary.org/obo/CHEBI_51364 http://purl.obolibrary.org/obo/CHEBI_5893 http://purl.obolibrary.org/obo/CHEBI_63621 http://purl.obolibrary.org/obo/dinto_DB00904 http://purl.obolibrary.org/obo/dinto_DB00308 http://purl.obolibrary.org/obo/CHEBI_10119 http://purl.obolibrary.org/obo/CHEBI_30621 http://purl.obolibrary.org/obo/CHEBI_3720 http://purl.obolibrary.org/obo/CHEBI_28593 http://purl.obolibrary.org/obo/dinto_DB01118 http://purl.obolibrary.org/obo/CHEBI_3061 http://purl.obolibrary.org/obo/CHEBI_4657 http://purl.obolibrary.org/obo/CHEBI_8428 |
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| prefixIRI |
obo2:CHEBI_71226 |
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| prefLabel |
telavancin |
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| SMILES |
Cl.CCCCCCCCCCNCCN[C@@]1(C)C[C@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2OC2=C3OC4=CC=C(C=C4Cl)[C@@H](O)[C@@H](NC(=O)[C@@H](CC(C)C)NC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]4C(C=C2OC2=CC=C(C=C2Cl)[C@@H](O)[C@@H]2NC(=O)[C@H](NC4=O)C4=CC=C(O)C(=C4)C4=C(C=C(O)C(CNCP(O)(O)=O)=C4O)[C@H](NC2=O)C(O)=O)=C3)O[C@@H](C)[C@H]1O |
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| Synonym |
C80H107Cl3N11O27P Td 6424 C80H106C12N11O27P.(HCl)n Vibativ (1S,2R,18R,19R,22S,25R,28R,40S)-22-(carbamoylmethyl)-5,15-dichloro-48-{[(2S,3R,4S,5S,6R)-3-{[(2S,4S,5S,6S)-4-{[2-(decylamino)ethyl]amino}-5-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,18,32,35,37-pentahydroxy-19-[(2R)-4-methyl-2-(methylamino)pentanamido]-20,23,26,42,44-pentaoxo-36-{[(phosphonomethyl)amino]methyl}-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.2?,?.2??,??.1?,??.1??,??.0??,??.0??,??]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34(39),35,37,46,49-pentadecaene-40-carboxylic acid hydrochloride telavancin hydrochloride Td-6424 |
|
| xref |
CiteXplore:18985183 CiteXplore:16894408 CiteXplore:17073522 CiteXplore:20140276 CASRN:560130-42-9 RxList:http://www.rxlist.com/vibativ-drug.htm CiteXplore:19088949 CiteXplore:22095816 CiteXplore:20199969 National Drug Code Directory:0469-3575-50 Reaxys:9988179 Wikipedia:http://en.wikipedia.org/wiki/Telavancin CiteXplore:20644442 CiteXplore:21137625 CiteXplore:18850047 CiteXplore:20208468 Drugs.com:http://www.drugs.com/cdi/telavancin.html CiteXplore:22095369 ChEBI:71226 CiteXplore:15834452 CiteXplore:21572764 CiteXplore:14576125 KEGG DRUG:D06057 CiteXplore:20401351 |
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| subClassOf |