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CHEBI:70199 - alpha-Conidendrin
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ChEBI Name
alpha-Conidendrin
ChEBI ID
CHEBI:70199
Definition
A natural product found in
Taxus yunnanensis
.
Stars
This entity has been manually annotated by a third party.
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Formula
C20H20O6
Net Charge
0
Average Mass
356.36920
Monoisotopic Mass
356.12599
InChI
InChI=1S/C20H20O6/c1-
24-
17-
6-
10(3-
4-
15(17)
21)
19-
12-
8-
16(22)
18(25-
2)
7-
11(12)
5-
13-
14(19)
9-
26-
20(13)
23/h3-
4,6-
8,13-
14,19,21-
22H,5,9H2,1-
2H3/t13-
,14+,19+/m1/s1
InChIKey
CAYMSCGTKZIVTN-TYILLQQXSA-N
SMILES
[H][C@]12COC(=O)[C@]1([H])Cc1cc(OC)c(O)cc1[C@@H]2c1ccc(O)c(OC)c1
Metabolite of Species
Details
Taxus yunnanensis
(NCBI:txid147275)
Found in xylem
(BTO:0001468)
. Previous component: wood; Aqueous extract of air-dried, powdered wood 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
alpha-Conidendrin (
CHEBI:70199
)
has role
metabolite (
CHEBI:25212
)
alpha-Conidendrin (
CHEBI:70199
)
is a
lignan (
CHEBI:25036
)
Synonym
Source
(3aR,9S,9aR)-
7-
hydroxy-
9-
(4-
hydroxy-
3-
methoxyphenyl)-
6-
methoxy-
3a,4,9,9a-
tetrahydro-
1H-
benzo[f][2]benzofuran-
3-
one
ChEBI
Registry Number
Type
Source
518-55-8
CAS Registry Number
ChemIDplus
Citation
Type
Source
21138310
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:naphthofuran(CHEBI:39270); ISA:tetralins(CHEBI:36786); ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:aromatic ether(CHEBI:35618); ISA:gamma-lactone(CHEBI:37581); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:polyol(CHEBI:26191); ISA:aromatic alcohol(CHEBI:33854); ISA:carbonyl compound(CHEBI:36586);