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ChEBI
> Main
CHEBI:67394 - S-3'-hydroxy-4,4'-dimethoxydalbergione
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ChEBI Ontology
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ChEBI Name
S-3'-hydroxy-4,4'-dimethoxydalbergione
ChEBI ID
CHEBI:67394
Definition
A natural product found in
Pterocarpus santalinus
.
Stars
This entity has been manually annotated by a third party.
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Formula
C17H16O5
Net Charge
0
Average Mass
300.30590
Monoisotopic Mass
300.09977
InChI
InChI=1S/C17H16O5/c1-
4-
11(10-
5-
6-
16(21-
2)
14(19)
7-
10)
12-
8-
15(20)
17(22-
3)
9-
13(12)
18/h4-
9,11,19H,1H2,2-
3H3/t11-
/m0/s1
InChIKey
BJJFYNLYABNPSS-NSHDSACASA-N
SMILES
COC1=CC(=O)C(=CC1=O)[C@@H](C=C)c1ccc(OC)c(O)c1
Metabolite of Species
Details
Pterocarpus santalinus
(NCBI:txid1071199)
Found in heartwood
(PO:0004512)
. Dichloromethane soluble portion of MeOH extract of powdered heartwood. 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
S-3'-hydroxy-4,4'-dimethoxydalbergione (
CHEBI:67394
)
has role
metabolite (
CHEBI:25212
)
S-3'-hydroxy-4,4'-dimethoxydalbergione (
CHEBI:67394
)
is a
1,4-benzoquinones (
CHEBI:132124
)
S-3'-hydroxy-4,4'-dimethoxydalbergione (
CHEBI:67394
)
is a
neoflavonoid (
CHEBI:71971
)
Synonym
Source
2-[(1S)-1-(3-Hydroxy-4-methoxyphenyl)-2-propen-1-yl]-5-methoxy-1,4-benzoquinone
ChEBI
Citation
Type
Source
21488654
PubMed citation
Europe PMC
Last Modified
03 June 2016
General Comment
2014-10-17
Suggested Classification: ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:olefinic compound(CHEBI:78840); ISA:p-quinone(CHEBI:25830); ISA:benzoquinones(CHEBI:22729); ISA:aromatic ether(CHEBI:35618); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:organic heterocyclic compound(CHEBI:24532); ISA:aromatic alcohol(CHEBI:33854);