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> Main
CHEBI:88362 - 7-hydroxysecoisolariciresinol
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ChEBI Name
7-hydroxysecoisolariciresinol
ChEBI ID
CHEBI:88362
Definition
A polyphenol that is (−)-secoisolariciresinol carrying an additional hydroxy substituent at position 7.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C20H26O7
Net Charge
0
Average Mass
378.417
Monoisotopic Mass
378.16785
InChI
InChI=1S/C20H26O7/c1-
26-
18-
8-
12(3-
5-
16(18)
23)
7-
14(10-
21)
15(11-
22)
20(25)
13-
4-
6-
17(24)
19(9-
13)
27-
2/h3-
6,8-
9,14-
15,20-
25H,7,10-
11H2,1-
2H3/t14-
,15-
,20?/m0/s1
InChIKey
VPDBTIFHPUYJJJ-HGUAOMBGSA-N
SMILES
C1=C(C(=CC=C1C([C@H]([C@@H](CC2=CC=C(C(=C2)OC)O)CO)CO)O)O)OC
Metabolite of Species
Details
Phyllanthus niruri
(NCBI:txid296034)
See:
MetaboLights Study
ChEBI Ontology
Outgoing
7-hydroxysecoisolariciresinol (
CHEBI:88362
)
has functional parent
(−)-secoisolariciresinol (
CHEBI:65004
)
7-hydroxysecoisolariciresinol (
CHEBI:88362
)
is a
lignan (
CHEBI:25036
)
7-hydroxysecoisolariciresinol (
CHEBI:88362
)
is a
methoxybenzenes (
CHEBI:51683
)
7-hydroxysecoisolariciresinol (
CHEBI:88362
)
is a
polyphenol (
CHEBI:26195
)
7-hydroxysecoisolariciresinol (
CHEBI:88362
)
is a
triol (
CHEBI:27136
)
IUPAC Name
(2
R
,3
R
)-
1-
(4-
hydroxy-
3-
methoxyphenyl)-
3-
[(4-
hydroxy-
3-
methoxyphenyl)methyl]-
2-
(hydroxymethyl)butane-
1,4-
diol
Registry Number
Type
Source
9225754
Reaxys Registry Number
Reaxys
Last Modified
08 June 2016