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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
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| Id | http://purl.obolibrary.org/obo/CHEBI_45367
http://purl.obolibrary.org/obo/CHEBI_45367
|
|---|---|
| Preferred Name | rifabutin |
| Synonyms |
C46H62N4O11
Rifabutin
4-N-isobutylspiropiperidylrifamycin S
(7S,11S,12R,13S,14R,15R,16R,17S,18S)-2,15,17-trihydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-1'-(2-methylpropyl)-6,23,32-trioxo-8,33-dioxa-24,27,29-triazaspiro[pentacyclo[23.6.1.1^{4,7}.0^{5,31}.0^{26,30}]tritriacontane-28,4'-piperidin]-1,3,5(31),9,19,21,25,29-octaen-13-yl acetate
Mycobutin (TN)
1,4-Dihydro-1-deoxy-1',4-didehydro-5'-(2-methylpropyl)-1-oxorifamycin XIV
4-Deoxo-3,4-(2-spiro(N-isobutyl-4-piperidyl)-2,5-dihydro-1H-imidazo)-rifamycin S
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| label |
rifabutin
|
|---|---|
| prefLabel |
rifabutin
|
| is metabolised by | |
| Definition |
A rifamycin that has formula C46H62N4O11.
|
| DBBrand |
ansamycin
alfacid
mycobutin
|
| ATCCode |
J04AB04
|
| SMILES |
CO[C@H]1\C=C\O[C@@]2(C)OC3=C(C2=O)C2=C(C(O)=C3C)C(=O)C(NC(=O)\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)=C1NC3(CCN(CC3)CC(C)C)N=C21
CO[C@H]1\\C=C\\O[C@@]2(C)Oc3c(C)c(O)c4C(=O)C(NC(=O)\\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)=C1NC5(CCN(CC5)CC(C)C)N=C1c4c3C2=O
|
| InChI |
InChI=1S/C46H62N4O11/c1-22(2)21-50-18-16-46(17-19-50)48-34-31-32-39(54)28(8)42-33(31)43(56)45(10,61-42)59-20-15-30(58-11)25(5)41(60-29(9)51)27(7)38(53)26(6)37(52)23(3)13-12-14-24(4)44(57)47-36(40(32)55)35(34)49-46/h12-15,20,22-23,25-27,30,37-38,41,49,52-54H,16-19,21H2,1-11H3,(H,47,57)/b13-12+,20-15+,24-14-/t23-,25+,26+,27+,30-,37-,38+,41+,45-/m0/s1
|
| CASRN |
72559-06-9
|
| prefixIRI |
obo2:CHEBI_45367
|
| altId |
CHEBI:8857
CHEBI:45364
|
| Synonym |
C46H62N4O11
Rifabutin
4-N-isobutylspiropiperidylrifamycin S
(7S,11S,12R,13S,14R,15R,16R,17S,18S)-2,15,17-trihydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-1'-(2-methylpropyl)-6,23,32-trioxo-8,33-dioxa-24,27,29-triazaspiro[pentacyclo[23.6.1.1^{4,7}.0^{5,31}.0^{26,30}]tritriacontane-28,4'-piperidin]-1,3,5(31),9,19,21,25,29-octaen-13-yl acetate
Mycobutin (TN)
1,4-Dihydro-1-deoxy-1',4-didehydro-5'-(2-methylpropyl)-1-oxorifamycin XIV
4-Deoxo-3,4-(2-spiro(N-isobutyl-4-piperidyl)-2,5-dihydro-1H-imidazo)-rifamycin S
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| has effect |
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| binds |
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| has role | |
| DBname |
rifabutin
|
| InChIKey |
InChIKey=ATEBXHFBFRCZMA-VXTBVIBXSA-N
|
| subClassOf | |
| inhibits | |
| related with | |
| induces | |
| is substrate of | |
| type | |
| xref |
PubChem Compound:6323490
ChEMBL:497074
KEGG DRUG:D00424
Wikipedia:http://en.wikipedia.org/wiki/Rifabutin
PharmGKB:PA451249
ChemSpider:4883445
DrugBank:DB00615
Drugs.com:http://www.drugs.com/cdi/rifabutin.html
RxList:http://www.rxlist.com/cgi/generic2/rifabutin.htm
ChEBI:8857
PDB:RBT
Drugs Product Database (DPD):2063786
PubChem Substance:46506468
CASRN:72559-06-9
Wikipedia:Rifabutin
National Drug Code Directory:0013-5301-17
KEGG COMPOUND:C07235
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|
| DBSynonym |
rbt
ansatipin
rifabutinum [latin]
ansatipine
rifabutina [spanish]
rifabutine [french]
antibiotic lm 427
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|
| AHFScode |
08:16.04
|
| has pharmacological target |
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