CHEBI:230474 - rhazimol(1+)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name rhazimol(1+)
ChEBI ID CHEBI:230474
Definition Major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information ChemicalBook:CB8346810, ChemicalBook:CB0356352, eMolecules:530018, ZINC000000057624
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Formula C21H25N2O3
Net Charge +1
Average Mass 353.441
Monoisotopic Mass 353.18597
InChI InChI=1S/C21H24N2O3/c1-3-13-11-23-9-8-20-14-6-4-5-7-16(14)22-18(20)17(23)10-15(13)21(20,12-24)19(25)26-2/h3-7,15,17,24H,8-12H2,1-2H3/p+1/b13-3-/t15-,17-,20+,21-/m0/s1
InChIKey XLHUHYFKFFGUFE-OQTQPSEISA-O
SMILES C/C=C\1/C[NH+]2CC[C@]34C5=CC=CC=C5N=C4[C@]2([H])C[C@@]1([C@@]3(CO)C(=O)OC)[H]
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing rhazimol(1+) (CHEBI:230474) is a ammonium ion derivative (CHEBI:35274)
rhazimol(1+) (CHEBI:230474) is a monoterpenoid indole alkaloid (CHEBI:65323)
Synonym Source
rhazimol UniProt
Manual Xref Database
CPD-27079 MetaCyc accession
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