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CHEBI:86530 - 1,2-diguaiacylpropane-1,3-diol
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ChEBI Name
1,2-diguaiacylpropane-1,3-diol
ChEBI ID
CHEBI:86530
Definition
A member of the class of propane-1,3-diols that is propane-1,3-diol substituted by 4-hydroxy-3-methoxyphenyl groups at positions 1 and 2 respectively.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C17H20O6
Net Charge
0
Average Mass
320.33710
Monoisotopic Mass
320.12599
InChI
InChI=1S/C17H20O6/c1-
22-
15-
7-
10(3-
5-
13(15)
19)
12(9-
18)
17(21)
11-
4-
6-
14(20)
16(8-
11)
23-
2/h3-
8,12,17-
21H,9H2,1-
2H3
InChIKey
DFUOJBWSSSODTR-UHFFFAOYSA-N
SMILES
COc1cc(ccc1O)C(O)C(CO)c1ccc(O)c(OC)c1
Metabolite of Species
Details
Artemisia iwayomogi
(NCBI:txid265784)
Found in aerial part
(BTO:0001658)
. See:
DOI
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1,2-diguaiacylpropane-1,3-diol (
CHEBI:86530
)
has role
plant metabolite (
CHEBI:76924
)
1,2-diguaiacylpropane-1,3-diol (
CHEBI:86530
)
is a
guaiacols (
CHEBI:134251
)
1,2-diguaiacylpropane-1,3-diol (
CHEBI:86530
)
is a
propane-1,3-diols (
CHEBI:26287
)
IUPAC Name
1,2-bis(4-hydroxy-3-methoxyphenyl)propane-1,3-diol
Registry Number
Type
Source
1892302
Reaxys Registry Number
Reaxys
Last Modified
07 April 2017