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(Q77512733)
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English
Sepedonin
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
224.068473484
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₂O₅
0 references
canonical SMILES
O=C1C=C(O)C2=C(C=C1O)CC(O)(OC2)C
0 references
found in taxon
Hypomyces chrysospermus
1 reference
stated in
Structure of sepedonin, a tropolone metabolite of Sepedomumchrysospermum Fries
Identifiers
InChI
InChI=1S/C11H12O5/c1-11(15)4-6-2-9(13)10(14)3-8(12)7(6)5-16-11/h2-3,12,15H,4-5H2,1H3,(H,13,14)
0 references
InChIKey
JKLMRPSQVILGMY-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
3083814
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
3083814
language of work or name
English
CAS Registry Number
3621-27-0
0 references
PubChem CID
3083814
1 reference
stated in
PubChem
PubChem CID
3083814
language of work or name
English
135600359
1 reference
matched by identifier from
InChIKey
InChIKey
JKLMRPSQVILGMY-UHFFFAOYSA-N
NMRShiftDB structure ID
10017740
1 reference
matched by identifier from
InChIKey
InChIKey
JKLMRPSQVILGMY-UHFFFAOYSA-N
DSSTox substance ID
DTXSID20957608
1 reference
matched by identifier from
InChIKey
InChIKey
JKLMRPSQVILGMY-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID701385541
0 references
Natural Product Atlas ID
NPA013027
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JKLMRPSQVILGMY-UHFFFAOYSA-N
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