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(Q77505140)
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English
Xylariaquinone A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
272.068473484
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₂O₅
0 references
canonical SMILES
CC1=CC(=O)C2=C(C1=O)OC3=C(C(=C(C=C23)OC)O)C
0 references
found in taxon
Xylaria
1 reference
stated in
Antimalarial benzoquinones from an endophytic fungus, Xylaria sp.
Identifiers
InChI
InChI=1S/C15H12O5/c1-6-4-9(16)11-8-5-10(19-3)13(18)7(2)14(8)20-15(11)12(6)17/h4-5,18H,1-3H3
0 references
InChIKey
PELMMCMFWVEXMP-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
23634443
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
23634443
language of work or name
English
CAS Registry Number
955016-67-8
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
23634443
2 references
stated in
PubChem
PubChem CID
23634443
language of work or name
English
matched by identifier from
InChIKey
InChIKey
PELMMCMFWVEXMP-UHFFFAOYSA-N
ChEBI ID
221003
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H12O5/c1-6-4-9(16)11-8-5-10(19-3)13(18)7(2)14(8)20-15(11)12(6)17/h4-5,18H,1-3H3
UniChem compound ID
320099
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID901210677
1 reference
matched by identifier from
InChIKey
InChIKey
PELMMCMFWVEXMP-UHFFFAOYSA-N
KNApSAcK ID
C00040707
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PELMMCMFWVEXMP-UHFFFAOYSA-N
Natural Product Atlas ID
NPA011776
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PELMMCMFWVEXMP-UHFFFAOYSA-N
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