CHEBI:69593 - marinacarboline B

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ChEBI Name marinacarboline B
ChEBI ID CHEBI:69593
Definition A natural product found in Marinactinospora thermotolerans.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H19N3O3
Net Charge 0
Average Mass 373.40460
Monoisotopic Mass 373.14264
InChI InChI=1S/C22H19N3O3/c1-13(26)20-21-17(16-4-2-3-5-18(16)24-21)12-19(25-20)22(28)23-11-10-14-6-8-15(27)9-7-14/h2-9,12,24,27H,10-11H2,1H3,(H,23,28)
InChIKey XHHABJFVNYNXCX-UHFFFAOYSA-N
SMILES CC(=O)c1nc(cc2c3ccccc3[nH]c12)C(=O)NCCc1ccc(O)cc1
Metabolite of Species Details
Marinactinospora thermotolerans (NCBI:txid531310) Found in mycelium (BTO:0001436). Crude extract of fermented medium inoculated with spores and mycelia of strain SCSIO 00652 See: PubMed
Marinactinospora thermotolerans (NCBI:txid531310) Found in spore (BTO:0001171). Crude extract of fermented medium inoculated with spores and mycelia of strain SCSIO 00652 See: PubMed
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 marinacarboline B (CHEBI:69593) is a β-carboline alkaloid (CHEBI:83325)
marinacarboline B (CHEBI:69593) is a methyl ketone (CHEBI:51867)
marinacarboline B (CHEBI:69593) is a monocarboxylic acid amide (CHEBI:29347)
marinacarboline B (CHEBI:69593) is a phenols (CHEBI:33853)
IUPAC Name
1-acetyl-N-[2-(4-hydroxyphenyl)ethyl]-9H-β-carboline-3-carboxamide
Synonym Source
4'O - desmethyl marinacarboline A ChEBI
Citation Waiting for Citations Type Source
21977916 PubMed citation Europe PMC
Last Modified
20 October 2014
General Comment
2014-10-17 Suggested Classification: ISA:beta-carbolines(CHEBI:60834); ISA:primary amine(CHEBI:32877); ISA:pyridinemonocarboxylic acid(CHEBI:26420); ISA:aromatic carboxylic acid(CHEBI:33859); ISA:indoles(CHEBI:24828); ISA:aromatic ketone(CHEBI:76224); ISA:aralkylamine(CHEBI:18000); ISA:phenols(CHEBI:33853); ISA:pyrroles(CHEBI:26455); ISA:enone(CHEBI:51689); ISA:enamine(CHEBI:47989); ISA:enol ether(CHEBI:47985); ISA:carboxamide(CHEBI:37622); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:aromatic alcohol(CHEBI:33854);