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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:3718 - cirsilineol
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ChEBI Name
cirsilineol
ChEBI ID
CHEBI:3718
Definition
A trimethoxyflavone that is flavone substituted by methoxy groups at positions 6, 7 and 3' and hydroxy groups at positions 5 and 4' respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C18H16O7
Net Charge
0
Average Mass
344.31540
Monoisotopic Mass
344.08960
InChI
InChI=1S/C18H16O7/c1-
22-
13-
6-
9(4-
5-
10(13)
19)
12-
7-
11(20)
16-
14(25-
12)
8-
15(23-
2)
18(24-
3)
17(16)
21/h4-
8,19,21H,1-
3H3
InChIKey
VKOSQMWSWLZQPA-UHFFFAOYSA-N
SMILES
COc1cc(ccc1O)-c1cc(=O)c2c(O)c(OC)c(OC)cc2o1
Metabolite of Species
Details
Artemisia chinensis
(NCBI:txid99046)
Found in leaf
(BTO:0000713)
. See:
PubMed
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.
Application
(s):
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cirsilineol (
CHEBI:3718
)
has functional parent
flavone (
CHEBI:42491
)
cirsilineol (
CHEBI:3718
)
has role
antineoplastic agent (
CHEBI:35610
)
cirsilineol (
CHEBI:3718
)
has role
plant metabolite (
CHEBI:76924
)
cirsilineol (
CHEBI:3718
)
is a
dihydroxyflavone (
CHEBI:38686
)
cirsilineol (
CHEBI:3718
)
is a
trimethoxyflavone (
CHEBI:27124
)
IUPAC Name
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,7-dimethoxy-4
H
-1-benzopyran-4-one
Manual Xrefs
Databases
C00013595
KNApSAcK
C10032
KEGG COMPOUND
Cirsilineol
Wikipedia
LMPK12111249
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1355108
Reaxys Registry Number
Reaxys
41365-32-6
CAS Registry Number
ChemIDplus
Citations
Types
Sources
24689280
PubMed citation
Europe PMC
25295671
PubMed citation
Europe PMC
Last Modified
04 June 2015