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The Prescription of Drugs Ontology
Last uploaded:
September 4, 2020
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| Preferred Name | Spectinomycin | |
| Synonyms |
spectinomycinum espectinomicina Antibiotic 2233wp spectinomycine spectinomycin (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one |
|
| Definitions |
A pyranobenzodioxin and antibiotic that is active against gram-negative bacteria and used (as its dihydrochloride pentahydrate) to treat gonorrhea. It is produced by the bacterium Streptomyces spectabilis. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_9215 |
|
| alternative term |
spectinomycinum espectinomicina Antibiotic 2233wp spectinomycine spectinomycin (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one
|
|
| bearer_of |
http://purl.obolibrary.org/obo/CHEBI_33281 |
|
| charge |
0
|
|
| database_cross_reference |
DrugBank:DB00919 PMID:30033166 PMID:24020122 Patent:WO2005041984 Patent:US4203903 KEGG:D08526 PMID:23847609 CAS:1695-77-8 Drug_Central:2468 KEGG:C02078 HMDB:HMDB0015055 LINCS:LSM-5298 PMID:32116136 Wikipedia:Spectinomycin PDBeChem:SCM PMID:24503209 PMID:23183436 Reaxys:2171701 PMID:24402501
|
|
| formula |
C14H24N2O7
|
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_33281 |
|
| has_alternative_id |
CHEBI:45551
|
|
| has_exact_synonym |
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
spectinomycinum espectinomicina Antibiotic 2233wp spectinomycine spectinomycin
|
|
| has_RxCUI |
270
|
|
| id |
CHEBI:9215
|
|
| in_subset | ||
| inchi |
InChI=1S/C14H24N2O7/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14/h5,7-13,15-16,18-20H,4H2,1-3H3/t5-,7-,8+,9+,10+,11-,12-,13+,14+/m1/s1
|
|
| inchikey |
UNFWWIHTNXNPBV-WXKVUWSESA-N
|
|
| is conjugate base of | ||
| label |
spectinomycin Spectinomycin
|
|
| mass |
332.34960
|
|
| monoisotopicmass |
332.15835
|
|
| notation |
CHEBI:9215
|
|
| prefixIRI |
CHEBI:9215
|
|
| prefLabel |
Spectinomycin
|
|
| smiles |
CN[C@@H]1[C@H](O)[C@H](NC)[C@H]2O[C@]3(O)[C@@H](O[C@H](C)CC3=O)O[C@@H]2[C@H]1O
|
|
| textual definition |
A pyranobenzodioxin and antibiotic that is active against gram-negative bacteria and used (as its dihydrochloride pentahydrate) to treat gonorrhea. It is produced by the bacterium Streptomyces spectabilis.
|
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_59780 http://purl.obolibrary.org/obo/CHEBI_50995 http://purl.obolibrary.org/obo/CHEBI_59770 http://purl.obolibrary.org/obo/CHEBI_146295 |
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