CHEBI:8230 - Pipecuronium

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Pipecuronium
ChEBI ID CHEBI:8230
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C35H62N4O4
Net Charge +2
Average Mass 602.893
Monoisotopic Mass 602.47601
InChI InChI=1S/C35H62N4O4/c1-24(40)42-32-21-26-9-10-27-28(35(26,4)23-31(32)37-15-19-39(7,8)20-16-37)11-12-34(3)29(27)22-30(33(34)43-25(2)41)36-13-17-38(5,6)18-14-36/h26-33H,9-23H2,1-8H3/q+2/t26-,27+,28-,29-,30-,31-,32-,33-,34-,35-/m0/s1
InChIKey OWWLUIWOFHMHOQ-XGHATYIMSA-N
SMILES CC(=O)O[C@H]1[C@H](C[C@H]2[C@@H]3CC[C@H]4C[C@H](OC(C)=O)[C@H](C[C@]4(C)[C@H]3CC[C@]12C)N1CC[N+](C)(C)CC1)N1CC[N+](C)(C)CC1
ChEBI Ontology
Outgoing Pipecuronium (CHEBI:8230) is a steroid ester (CHEBI:47880)
Synonyms Sources
Pipecuronium KEGG COMPOUND
pipecuronium bromide DrugCentral
Manual Xrefs Databases
2183 DrugCentral
C07554 KEGG COMPOUND
HMDB0015431 HMDB
View more database links
Registry Number Type Source
68399-58-6 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017