CHEBI:73453 - methoctramine(4+)

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ChEBI Name methoctramine(4+)
ChEBI ID CHEBI:73453
Definition An organic cation obtained by protonation of the four amino groups of methoctramine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C36H66N4O2
Net Charge +4
Average Mass 586.93480
Monoisotopic Mass 586.51638
InChI InChI=1S/C36H62N4O2/c1-41-35-23-13-11-21-33(35)31-39-29-19-9-7-17-27-37-25-15-5-3-4-6-16-26-38-28-18-8-10-20-30-40-32-34-22-12-14-24-36(34)42-2/h11-14,21-24,37-40H,3-10,15-20,25-32H2,1-2H3/p+4
InChIKey RPMBYDYUVKEZJA-UHFFFAOYSA-R
SMILES COc1ccccc1C[NH2+]CCCCCC[NH2+]CCCCCCCC[NH2+]CCCCCC[NH2+]Cc1ccccc1OC
ChEBI Ontology
Outgoing methoctramine(4+) (CHEBI:73453) is a ammonium ion derivative (CHEBI:35274)
methoctramine(4+) (CHEBI:73453) is a organic cation (CHEBI:25697)
methoctramine(4+) (CHEBI:73453) is conjugate acid of methoctramine (CHEBI:73339)
Incoming methoctramine tetrahydrochloride (CHEBI:73452) has part methoctramine(4+) (CHEBI:73453)
methoctramine (CHEBI:73339) is conjugate base of methoctramine(4+) (CHEBI:73453)
IUPAC Name
N,N'-bis{6-[(2-methoxybenzyl)azaniumyl]hexyl}octane-1,8-diaminium
Synonyms Sources
methoctramine tetracation ChEBI
methoctraminium(4+) ChEBI
Last Modified
01 May 2013