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BioModels Ontology
Last uploaded:
April 3, 2012
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| Preferred Name | rocuronium | |
| Synonyms |
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| Definitions |
A 5alpha androstane compound having 3alpha-hydroxy-, 17beta-acetoxy-, 2beta-morpholino- and 16beta-N-allyllyrrolidinium substituents. |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_8884 |
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| alternative term |
C32H53N2O4 InChI=1S/C32H53N2O4/c1-5-14-34(15-6-7-16-34)28-20-26-24-9-8-23-19-29(36)27(33-12-17-37-18-13-33)21-32(23,4)25(24)10-11-31(26,3)30(28)38-22(2)35/h5,23-30,36H,1,6-21H2,2-4H3/q+1/t23-,24+,25-,26-,27-,28-,29-,30-,31-,32-/m0/s1 (2beta,3alpha,5alpha,16beta,17beta)-17-acetoxy-16-(1-allylpyrrolidinium-1-yl)-3-hydroxy-2-(morpholin-4-yl)androstane InChIKey=YXRDKMPIGHSVRX-OOJCLDBCSA-N [H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@@H](OC(C)=O)[C@H](C[C@@]34[H])[N+]3(CCCC3)CC=C)[C@@]1(C)C[C@@H]([C@@H](O)C2)N1CCOCC1
|
|
| definition |
A 5alpha androstane compound having 3alpha-hydroxy-, 17beta-acetoxy-, 2beta-morpholino- and 16beta-N-allyllyrrolidinium substituents.
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| has parent hydride | ||
| has role | ||
| label |
rocuronium
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| prefixIRI |
CHEBI:8884
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| prefLabel |
rocuronium
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| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_35509 |
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