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berbamuninium(2+)
"Dication of berbamunine arsing from protonation of both tertiary amino groups; major species at pH 7.3."


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04. Bioactive Capabilities of Specific Chemicals  
04. Bioactive Capabilities of Specific Chemicals
 Oxidoreductases [EC:1] (1697) 
 Acting on paired donors, with incorporation or reduction of molecular oxygen [EC:1.14] (587) 
 With NADH or NADPH as one donor, and the other dehydrogenated [EC:1.14.21] (28) 
 Berbamunine synthase [EC:1.14.21.3] (8) 
 berbamuninium(2+) [CHEBI:57894] (1)
08. Chemical Category 
08. Chemical Category
 ion [CHEBI:24870] (4391) 
 polyatomic ion [CHEBI:36358] (2633) 
 polyatomic cation [CHEBI:33702] (611) 
 ammonium ion [CHEBI:35274] (507) 
 berbamuninium(2+) [CHEBI:57894] (1)
 cation [CHEBI:36916] (947) 
 polyatomic cation [CHEBI:33702] (611) 
 ammonium ion [CHEBI:35274] (507) 
 berbamuninium(2+) [CHEBI:57894] (1)
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 pnictogen molecular entity [CHEBI:33302] (10027) 
 nitrogen molecular entity [CHEBI:51143] (7930) 
 ammonium ion [CHEBI:35274] (507) 
 berbamuninium(2+) [CHEBI:57894] (1)
 polyatomic entity [CHEBI:36357] (18777) 
 polyatomic ion [CHEBI:36358] (2633) 
 polyatomic cation [CHEBI:33702] (611) 
 ammonium ion [CHEBI:35274] (507) 
 berbamuninium(2+) [CHEBI:57894] (1)
ChEBI Compound Accession Identifier  [CHEBI:57894]
ChEBI Compound Description  "Dication of berbamunine arsing from protonation of both tertiary amino groups; major species at pH 7.3."
ChEBI Compound Identification Number  57894
ChEBI InChI Value  InChI=1S/C36H40N2O6/c1-37-13-11-24-18-34(42-3)32(40)20-27(24)29(37)15-22-5-8-26(9-6-22)44-36-17-23(7-10-31(36)39)16-30-28-21-33(41)35(43-4)19-25(28)12-14-38(30)2/h5-10,17-21,29-30,39-41H,11-16H2,1-4H3/p+2/t29-,30+/m0/s1
ChEBI InChIKey Value  FDABVSXGAMFQQH-XZWHSSHBSA-P
ChEBI Compound Name  berbamuninium(2+)
ChEBI SMILES Value  COc1cc2CC[NH+](C)[C@@H](Cc3ccc(Oc4cc(C[C@H]5[NH+](C)CCc6cc(OC)c(O)cc56)ccc4O)cc3)c2cc1O
ChEBI Substance ID  99437506
ChEBI URL  ChEBI:57894
ChemSpider ID  26330956
Ontomatica Chemical Accession Key (OnChAKey)  FDABVSXGAMFQQH_XZWHSSHBSA_P_000_000000
PubChem Compound ID  46931116