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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:134011 - artemoin D
Main
ChEBI Ontology
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ChEBI Name
artemoin D
ChEBI ID
CHEBI:134011
Definition
An artemoin in which the two hydroxy groups on the C-30 side-chain are located at positions 13 and 14
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Molfile
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Molfile
Formula
C35H66O4
Net Charge
0
Average Mass
550.897
Monoisotopic Mass
550.49611
InChI
InChI=1S/C35H66O4/c1-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
16-
19-
22-
25-
28-
33(36)
34(37)
29-
26-
23-
20-
17-
14-
13-
15-
18-
21-
24-
27-
32-
30-
31(2)
39-
35(32)
38/h30-
31,33-
34,36-
37H,3-
29H2,1-
2H3
InChIKey
CAGLXILDKKCMCR-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCCC1=CC(C)OC1=O)O)O
Metabolite of Species
Details
Annona atemoya
(IPNI:1006408-1)
Found in seed
(BTO:0001226)
. See:
DOI
Mus musculus
(NCBI:txid10090)
See:
MetaboLights Study
Rattus norvegicus
(NCBI:txid10116)
See:
MetaboLights Study
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.
(via
artemoin
)
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
rat metabolite
Any mammalian metabolite produced during a metabolic reaction in rat (
Rattus norvegicus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
artemoin D (
CHEBI:134011
)
has role
mouse metabolite (
CHEBI:75771
)
artemoin D (
CHEBI:134011
)
has role
plant metabolite (
CHEBI:76924
)
artemoin D (
CHEBI:134011
)
has role
rat metabolite (
CHEBI:86264
)
artemoin D (
CHEBI:134011
)
is a
artemoin (
CHEBI:134234
)
IUPAC Name
3-(13,14-dihydroxytriacontyl)-5-methylfuran-2(5
H
)-one
Synonyms
Sources
3-(13,14-Dihydroxytriacontyl)-5-methyl-2(5H)-furanone
HMDB
artemoin-D
ChEBI
Manual Xref
Database
HMDB0033607
HMDB
View more database links
Registry Number
Type
Source
8301353
Reaxys Registry Number
Reaxys
Last Modified
16 May 2017