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ChEBI
> Main
CHEBI:133763 - YWA1
Main
ChEBI Ontology
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ChEBI Name
YWA1
ChEBI ID
CHEBI:133763
Definition
A heptaketide that is 2,3-dihydro-4
H
-benzo[
g
]chromen-4-one bearing a methyl substituent at position 2 and four hydroxy substituents at positions 2, 5, 6 and 8.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Julian Brandl
Supplier Information
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Formula
C14H12O6
Net Charge
0
Average Mass
276.242
Monoisotopic Mass
276.06339
InChI
InChI=1S/C14H12O6/c1-
14(19)
5-
9(17)
12-
10(20-
14)
3-
6-
2-
7(15)
4-
8(16)
11(6)
13(12)
18/h2-
4,15-
16,18-
19H,5H2,1H3
InChIKey
RTYDQIKVNMHQMZ-UHFFFAOYSA-N
SMILES
C=1(C=2C(C=C(C1)O)=CC3=C(C2O)C(CC(O3)(O)C)=O)O
Metabolite of Species
Details
Aspergillus nidulans
(NCBI:txid162425)
See:
PubMed
Aspergillus fumigatus
(NCBI:txid746128)
See:
PubMed
Roles Classification
Biological Role
(s):
Aspergillus metabolite
Any fungal metabolite produced during a metabolic reaction in the mould,
Aspergillus
.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
YWA1 (
CHEBI:133763
)
has role
Aspergillus
metabolite (
CHEBI:76956
)
YWA1 (
CHEBI:133763
)
is a
cyclic hemiketal (
CHEBI:59780
)
YWA1 (
CHEBI:133763
)
is a
heptaketide (
CHEBI:59872
)
YWA1 (
CHEBI:133763
)
is a
naphtho-γ-pyrone (
CHEBI:64542
)
YWA1 (
CHEBI:133763
)
is a
phenols (
CHEBI:33853
)
IUPAC Name
2,5,6,8-tetrahydroxy-2-methyl-2,3-dihydro-4
H
-naphtho[2,3-
b
]pyran-4-one
Synonyms
Sources
demethylfonsecin
ChEBI
desmethylfonsecin
ChEBI
naphtopyrone YWA1
UniProt
O-Demethylfonsecin
HMDB
Manual Xrefs
Databases
100923872
PubChem
CPD-18255
MetaCyc
HMDB0033649
HMDB
View more database links
Registry Number
Type
Source
8223234
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11251292
PubMed citation
Europe PMC
15310761
PubMed citation
Europe PMC
15324811
PubMed citation
Europe PMC
18676950
PubMed citation
Europe PMC
21296881
PubMed citation
Europe PMC
22713716
PubMed citation
Europe PMC
23557488
PubMed citation
Europe PMC
26132344
PubMed citation
Europe PMC
Last Modified
19 May 2022