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ChEBI
> Main
CHEBI:70511 - angustilobine B, (rac)-
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ChEBI Ontology
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ChEBI Name
angustilobine B, (rac)-
ChEBI ID
CHEBI:70511
Definition
A natural product found in
Alstonia spatulata
.
Stars
This entity has been manually annotated by a third party.
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Formula
C20H22N2O3
Net Charge
0
Average Mass
338.40030
Monoisotopic Mass
338.16304
InChI
InChI=1S/C20H22N2O3/c1-
24-
19(23)
20-
12-
25-
9-
7-
13-
10-
22(8-
6-
16(13)
20)
11-
15-
14-
4-
2-
3-
5-
17(14)
21-
18(15)
20/h2-
5,7,16,21H,6,8-
12H2,1H3
InChIKey
IFPNVCKONQNHIZ-UHFFFAOYSA-N
SMILES
COC(=O)C12COCC=C3CN(CCC13)Cc1c2[nH]c2ccccc12
Metabolite of Species
Details
Alstonia
sp.
tulata
(IPNI:76595-1)
Found in stem
(BTO:0001300)
. Previous component: stem bark; Extraction of stembark with concentrated EtOH with dilute acids 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
angustilobine B, (rac)- (
CHEBI:70511
)
has role
metabolite (
CHEBI:25212
)
angustilobine B, (rac)- (
CHEBI:70511
)
is a
alkaloid (
CHEBI:22315
)
Citation
Type
Source
21043460
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:indoles(CHEBI:24828); ISA:aralkylamine(CHEBI:18000); ISA:piperidines(CHEBI:26151); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:carboxylic ester(CHEBI:33308); ISA:pyrroles(CHEBI:26455); ISA:tertiary amine(CHEBI:32876); ISA:organonitrogen compound(CHEBI:35352); ISA:monocarboxylic acid(CHEBI:25384); ISA:ether(CHEBI:25698); ISA:carbonyl compound(CHEBI:36586);