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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:70349 - Bussealin B
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ChEBI Ontology
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ChEBI Name
Bussealin B
ChEBI ID
CHEBI:70349
Definition
A natural product found in
Bussea sakalava
.
Stars
This entity has been manually annotated by a third party.
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Formula
C18H22O6
Net Charge
0
Average Mass
334.36370
Monoisotopic Mass
334.14164
InChI
InChI=1S/C18H22O6/c1-
22-
14-
8-
7-
11(17(20)
18(14)
21)
5-
4-
6-
12-
9-
13(19)
16(24-
3)
10-
15(12)
23-
2/h7-
10,19-
21H,4-
6H2,1-
3H3
InChIKey
MFDOSUHLWKCGJQ-UHFFFAOYSA-N
SMILES
COc1cc(OC)c(CCCc2ccc(OC)c(O)c2O)cc1O
Metabolite of Species
Details
Bussea sakalava
(NCBI:txid321565)
Found in root
(BTO:0001188)
. Dried, ground roots were extracted with ethanol by percolation 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Bussealin B (
CHEBI:70349
)
has role
metabolite (
CHEBI:25212
)
Bussealin B (
CHEBI:70349
)
is a
phenols (
CHEBI:33853
)
Synonym
Source
5',2'',3''-Trihydroxy-2',4',4''-trimethoxy-1,3-diphenylpropane
ChEBI
Citation
Type
Source
20942441
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:benzenetriol(CHEBI:22707); ISA:catechols(CHEBI:33566); ISA:aromatic ether(CHEBI:35618); ISA:polyol(CHEBI:26191); ISA:organic heterocyclic compound(CHEBI:24532); ISA:aromatic alcohol(CHEBI:33854);