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ChEBI
> Main
CHEBI:69593 - marinacarboline B
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ChEBI Ontology
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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.
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Molfile
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
)
View more via ChEBI Ontology
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]-9
H
-β-carboline-3-carboxamide
Synonym
Source
4'
O
- desmethyl marinacarboline A
ChEBI
Citation
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);