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(Q77375768)
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English
Pestalotiopyrone H
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
6-[1-(4-Hydroxy-5-oxooxolan-2-yl)prop-1-en-2-yl]-4-methoxypyran-2-one
1 reference
based on heuristic
inferred from SMILES
mass
266.079038168
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₄O₆
0 references
canonical SMILES
O=C1OC(=CC(OC)=C1)C(=CC2OC(=O)C(O)C2)C
0 references
isomeric SMILES
C/C(=C\[C@H]1C[C@H](C(=O)O1)O)/C2=CC(=CC(=O)O2)OC
0 references
found in taxon
Pestalotiopsis
1 reference
stated in
Polyketide derivatives of endophytic fungus Pestalotiopsis sp. isolated from the Chinese mangrove plant Rhizophora mucronata
Identifiers
InChI
InChI=1S/C13H14O6/c1-7(3-9-4-10(14)13(16)18-9)11-5-8(17-2)6-12(15)19-11/h3,5-6,9-10,14H,4H2,1-2H3/b7-3+/t9-,10+/m0/s1
0 references
InChIKey
VTBDISGBHVWSMH-DRDGLUHNSA-N
2 references
stated in
PubChem
PubChem CID
52920647
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
52920647
language of work or name
English
PubChem CID
52920647
2 references
stated in
PubChem
PubChem CID
52920647
language of work or name
English
matched by identifier from
InChIKey
InChIKey
VTBDISGBHVWSMH-DRDGLUHNSA-N
ChEBI ID
203152
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H14O6/c1-7(3-9-4-10(14)13(16)18-9)11-5-8(17-2)6-12(15)19-11/h3,5-6,9-10,14H,4H2,1-2H3/b7-3+/t9-,10+/m0/s1
UniChem compound ID
32747081
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA006061
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VTBDISGBHVWSMH-DRDGLUHNSA-N
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