CHEBI:142754 - akuammicine(1+)

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ChEBI Name akuammicine(1+)
ChEBI ID CHEBI:142754
Definition An ammonium ion that is the conjugate acid of akuammicine, arising from the protonation of the tertiary amino group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
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Formula C20H23N2O2
Net Charge +1
Average Mass 323.410
Monoisotopic Mass 323.17540
InChI InChI=1S/C20H22N2O2/c1-3-12-11-22-9-8-20-14-6-4-5-7-15(14)21-18(20)17(19(23)24-2)13(12)10-16(20)22/h3-7,13,16,21H,8-11H2,1-2H3/p+1/b12-3-/t13-,16-,20+/m0/s1
InChIKey AGZMFTKKLPHOMT-DUJTVWLASA-O
SMILES C=12[C@@]3([C@H]4[NH+](CC3)C\C(\[C@@](C1C(=O)OC)(C4)[H])=C\C)C5=CC=CC=C5N2
ChEBI Ontology
Outgoing akuammicine(1+) (CHEBI:142754) is a ammonium ion derivative (CHEBI:35274)
akuammicine(1+) (CHEBI:142754) is conjugate acid of akuammicine (CHEBI:70499)
Incoming akuammicine (CHEBI:70499) is conjugate base of akuammicine(1+) (CHEBI:142754)
IUPAC Name
(19E)-17-methoxy-17-oxo-2,16-didehydrocur-19-en-4-ium
Synonym Source
akuammicine UniProt
Manual Xref Database
CPD-21553 MetaCyc
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Last Modified
10 December 2018