The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
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

ID

http://purl.obolibrary.org/obo/CHEBI_45367

AHFScode

08:16.04

altId

CHEBI:8857

CHEBI:45364

ATCCode

J04AB04

CASRN

72559-06-9

DBBrand

ansamycin

alfacid

mycobutin

DBname

rifabutin

DBSynonym

rbt

ansatipin

rifabutinum [latin]

ansatipine

rifabutina [spanish]

rifabutine [french]

antibiotic lm 427

Definition

A rifamycin that has formula C46H62N4O11.

has effect

http://purl.obolibrary.org/obo/OAE_0000599

http://purl.obolibrary.org/obo/OAE_0000453

http://purl.obolibrary.org/obo/OAE_0001154

http://purl.obolibrary.org/obo/OAE_0000823

http://purl.obolibrary.org/obo/OAE_0000377

http://purl.obolibrary.org/obo/OAE_0000839

http://purl.obolibrary.org/obo/OAE_0000406

http://purl.obolibrary.org/obo/OAE_0000825

http://purl.obolibrary.org/obo/OAE_0000443

http://purl.obolibrary.org/obo/OAE_0000308

http://purl.obolibrary.org/obo/OAE_0000210

http://purl.obolibrary.org/obo/OAE_0000319

http://purl.obolibrary.org/obo/OAE_0001448

http://purl.obolibrary.org/obo/OAE_0000382

http://purl.obolibrary.org/obo/OAE_0001025

http://purl.obolibrary.org/obo/OAE_0000600

http://purl.obolibrary.org/obo/OAE_0000310

http://purl.obolibrary.org/obo/OAE_0000476

http://purl.obolibrary.org/obo/OAE_0000920

http://purl.obolibrary.org/obo/OAE_0000770

http://purl.obolibrary.org/obo/OAE_0000601

http://purl.obolibrary.org/obo/OAE_0000375

http://purl.obolibrary.org/obo/OAE_0001275

http://purl.obolibrary.org/obo/OAE_0000455

http://purl.obolibrary.org/obo/OAE_0000268

http://purl.obolibrary.org/obo/OAE_0000584

http://purl.obolibrary.org/obo/OAE_0001129

http://purl.obolibrary.org/obo/OAE_0002206

http://purl.obolibrary.org/obo/OAE_0000613

http://purl.obolibrary.org/obo/OAE_0000536

http://purl.obolibrary.org/obo/OAE_0000385

http://purl.obolibrary.org/obo/OAE_0000468

http://purl.obolibrary.org/obo/OAE_0000487

http://purl.obolibrary.org/obo/OAE_0001217

http://purl.obolibrary.org/obo/OAE_0000396

http://purl.obolibrary.org/obo/OAE_0000362

http://purl.obolibrary.org/obo/OAE_0000374

http://purl.obolibrary.org/obo/OAE_0000480

http://purl.obolibrary.org/obo/OAE_0000402

has pharmacological target

http://purl.obolibrary.org/obo/dinto_0124

http://purl.obolibrary.org/obo/dinto_1425

http://purl.obolibrary.org/obo/dinto_2084

has role

http://purl.obolibrary.org/obo/CHEBI_33231

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

InChIKey

InChIKey=ATEBXHFBFRCZMA-VXTBVIBXSA-N

induces

http://purl.obolibrary.org/obo/dinto_0901

inhibits

http://purl.obolibrary.org/obo/dinto_0124

http://purl.obolibrary.org/obo/dinto_1425

http://purl.obolibrary.org/obo/dinto_2084

is metabolised by

http://purl.obolibrary.org/obo/dinto_2651

http://purl.obolibrary.org/obo/dinto_0901

label

rifabutin

prefixIRI

obo2:CHEBI_45367

prefLabel

rifabutin

related with

http://purl.obolibrary.org/obo/dinto_4244

http://purl.obolibrary.org/obo/dinto_1761

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

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

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

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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http://purl.obolibrary.org/obo/CHEBI_45367 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45367 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45367 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45367 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45367 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45367 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45367 PHIPO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45367 GENEPIO SAME_URI
http://purl.bioontology.org/ontology/MESH/D017828 MESH LOOM
http://purl.obolibrary.org/obo/ARO_3000530 ARO LOOM
http://purl.bioontology.org/ontology/LNC/MTHU006676 LOINC LOOM
http://www.drugbank.ca/drugs/DB00615 FTC LOOM
http://purl.bioontology.org/ontology/ATC/J04AB04 ATC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0140575 OCHV LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C1408 NCIT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#16476 OCHV LOOM
http://purl.bioontology.org/ontology/LNC/LP14435-9 LOINC LOOM
http://purl.bioontology.org/ontology/NDDF/004117 NDDF LOOM
http://purl.bioontology.org/ontology/CSP/4007-0110 CRISP LOOM
http://purl.bioontology.org/ontology/PDQ/CDR0000037812 PDQ LOOM
http://purl.bioontology.org/ontology/RXNORM/55672 RXNORM LOOM
http://purl.obolibrary.org/obo/MESH_D017828 BERO LOOM
http://stirdf.jst.go.jp/id/200907011301025469 IOBC LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D017828 RH-MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.549.811.650 RH-MESH LOOM
http://purl.obolibrary.org/obo/OMIT_0018106 OMIT LOOM
http://purl.obolibrary.org/obo/NCIT_C1408 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 NIFSTD LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 PHIPO LOOM
http://purl.obolibrary.org/obo/CHEBI_45367 GENEPIO LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D04.345.295.750.650 RH-MESH LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148321 NDFRT LOOM
http://www.phoc.org.cn/pmo/class/PMO_00018048 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/VANDF/4020770 VANDF LOOM
http://purl.jp/bio/4/id/200906073685339416 IOBC LOOM
http://www.co-ode.org/ontologies/galen#Rifabutin GALEN LOOM
http://purl.bioontology.org/ontology/RCD/ed8.. RCD LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/386893001 SNOMEDCT LOOM
https://go.drugbank.com/drugs/DB00615 MDM LOOM