Completing data — usually done within a minute
Basic information
- Standard SMILES
C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](O)[C@@H](N6CCOCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(C)=O)CCCC1.[Br-]- InChIKey
OYTJKRAYGYRUJK-FMCCZJBLSA-M- Molecular formula
- C32H53BrN2O4
- Average molar mass
- 609.69 g/mol
- Monoisotopic mass
- 608.31887028
Names & identifiers
- Preferred name
- Rocuronium bromide
- IUPAC
- 17beta-(Acetyloxy)-3alpha-hydroxy-2beta-(morpholin-4-yl)-16beta-[1-(prop-2-en-1-yl)pyrrolidin-1-ium-1-yl]-5alpha-androstane bromide
Database identifiers
- CAS
119302-91-9- PubChem CID
- 441351
- DTXSID
DTXSID7023566- ChEMBL
CHEMBL1200648- ChEBI
CHEBI:8885- UNII
- I65MW4OFHZ
- EC Number
- 601-597-6
Related reactions
4 records
Linked notes
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