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(Q77516188)
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English
Xyloketal D
bioactive natural product
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
(3,9a-Dimethyl-5-hydroxy-2,3,3a,9a-tetrahydro-4H-furo[2,3-b][1]benzopyran-6-yl)(methyl) ketone
1 reference
based on heuristic
inferred from SMILES
mass
262.120509056
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₈O₄
0 references
canonical SMILES
O=C(C1=CC=C2OC3(OCC(C)C3CC2=C1O)C)C
0 references
isomeric SMILES
C[C@H]1CO[C@]2([C@@H]1CC3=C(O2)C=CC(=C3O)C(=O)C)C
0 references
found in taxon
Xylaria
2 references
stated in
Five unique compounds: xyloketals from mangrove fungus Xylaria sp. from the South China Sea coast.
stated in
Five unique compounds: xyloketals from mangrove fungus Xylaria sp. from the South China Sea coast.
Identifiers
InChI
InChI=1S/C15H18O4/c1-8-7-18-15(3)12(8)6-11-13(19-15)5-4-10(9(2)16)14(11)17/h4-5,8,12,17H,6-7H2,1-3H3/t8-,12+,15+/m0/s1
0 references
InChIKey
IIAGASOFCPRGKH-IBRIGMFSSA-N
2 references
stated in
PubChem
PubChem CID
11242469
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11242469
language of work or name
English
PubChem CID
11242469
2 references
stated in
PubChem
PubChem CID
11242469
language of work or name
English
matched by identifier from
InChIKey
InChIKey
IIAGASOFCPRGKH-IBRIGMFSSA-N
UniChem compound ID
33712418
1 reference
stated in
UniChem
NMRShiftDB structure ID
20181370
1 reference
matched by identifier from
InChIKey
InChIKey
IIAGASOFCPRGKH-IBRIGMFSSA-N
Natural Product Atlas ID
NPA013588
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IIAGASOFCPRGKH-IBRIGMFSSA-N
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