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> Main
CHEBI:9024 - santin
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ChEBI Name
santin
ChEBI ID
CHEBI:9024
Definition
A trimethoxyflavone that is flavone substituted by methoxy groups at positions 3, 6 and 4' and hydroxy groups at positions 5 and 7 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-
10-
6-
4-
9(5-
7-
10)
16-
18(24-
3)
15(21)
13-
12(25-
16)
8-
11(19)
17(23-
2)
14(13)
20/h4-
8,19-
20H,1-
3H3
InChIKey
DWZAJFZEYZIHPO-UHFFFAOYSA-N
SMILES
COc1ccc(cc1)-c1oc2cc(O)c(OC)c(O)c2c(=O)c1OC
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
santin (
CHEBI:9024
)
has functional parent
flavone (
CHEBI:42491
)
santin (
CHEBI:9024
)
has role
plant metabolite (
CHEBI:76924
)
santin (
CHEBI:9024
)
is a
dihydroxyflavone (
CHEBI:38686
)
santin (
CHEBI:9024
)
is a
trimethoxyflavone (
CHEBI:27124
)
IUPAC Name
5,7-dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)-4
H
-1-benzopyran-4-one
Synonym
Source
5,7-dihydroxy-3,6,4'-trimethoxy flavone
ChEBI
Manual Xrefs
Databases
C00001096
KNApSAcK
C10180
KEGG COMPOUND
LMPK12112861
LIPID MAPS
Santin_(flavonol)
Wikipedia
View more database links
Registry Numbers
Types
Sources
1355698
Reaxys Registry Number
Reaxys
27782-63-4
CAS Registry Number
KEGG COMPOUND
Last Modified
05 June 2015