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CHEBI:68173 - (+)-guaiacin
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ChEBI Ontology
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ChEBI Name
(+)-guaiacin
ChEBI ID
CHEBI:68173
Definition
A natural product found in
Machilus robusta
.
Stars
This entity has been manually annotated by a third party.
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Formula
C20H24O4
Net Charge
0
Average Mass
328.40220
Monoisotopic Mass
328.16746
InChI
InChI=1S/C20H24O4/c1-
11-
7-
14-
9-
19(24-
4)
17(22)
10-
15(14)
20(12(11)
2)
13-
5-
6-
16(21)
18(8-
13)
23-
3/h5-
6,8-
12,20-
22H,7H2,1-
4H3/t11-
,12+,20+/m1/s1
InChIKey
TZAAYUCUPIYQBR-JGRMJRGVSA-N
SMILES
COc1cc(ccc1O)[C@@H]1[C@@H](C)[C@H](C)Cc2cc(OC)c(O)cc12
Metabolite of Species
Details
Machilus robusta
(NCBI:txid460780)
Found in bark
(BTO:0001301)
. 95%aqueous EtOH extract of air-dried bark 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
(+)-guaiacin (
CHEBI:68173
)
has role
metabolite (
CHEBI:25212
)
(+)-guaiacin (
CHEBI:68173
)
is a
lignan (
CHEBI:25036
)
Synonym
Source
(6R,7S,8S)-8-(4-Hydroxy-3-methoxyphenyl)-3-methoxy-6,7-dimethyl-5,6,7,8-tetrahydro-2-naphthalenol
ChEBI
Citation
Type
Source
21627109
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:tetralins(CHEBI:36786); ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:aromatic ether(CHEBI:35618); ISA:polyol(CHEBI:26191); ISA:organic heterocyclic compound(CHEBI:24532); ISA:aromatic alcohol(CHEBI:33854);