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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:2382 - acerosin
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ChEBI Name
acerosin
ChEBI ID
CHEBI:2382
Definition
A trihydroxyflavone that is 5,7,3'-trihydroxyflavone with methoxy substituents at positions 6, 8 and 4' respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C18H16O8
Net Charge
0
Average Mass
360.31484
Monoisotopic Mass
360.08452
InChI
InChI=1S/C18H16O8/c1-
23-
11-
5-
4-
8(6-
9(11)
19)
12-
7-
10(20)
13-
14(21)
17(24-
2)
15(22)
18(25-
3)
16(13)
26-
12/h4-
7,19,21-
22H,1-
3H3
InChIKey
BTMNGQCCCWTUQH-UHFFFAOYSA-N
SMILES
COc1ccc(cc1O)-c1cc(=O)c2c(O)c(OC)c(O)c(OC)c2o1
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
acerosin (
CHEBI:2382
)
has role
metabolite (
CHEBI:25212
)
acerosin (
CHEBI:2382
)
is a
trihydroxyflavone (
CHEBI:27116
)
acerosin (
CHEBI:2382
)
is a
trimethoxyflavone (
CHEBI:27124
)
IUPAC Name
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,8-dimethoxy-4
H
-chromen-4-one
Synonyms
Sources
5,7,3'-trihydroxy-6,8,4'-trimethoxyflavone
ChEBI
Acerosin
KEGG COMPOUND
Manual Xrefs
Databases
C00003930
KNApSAcK
C09982
KEGG COMPOUND
HMDB0030812
HMDB
LMPK12111473
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1406179
Reaxys Registry Number
Reaxys
15835-74-2
CAS Registry Number
KEGG COMPOUND
15835-74-2
CAS Registry Number
ChemIDplus
Citation
Type
Source
11198823
PubMed citation
Europe PMC
Last Modified
28 July 2014