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(Q110170802)
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English
(15R)-acetoxydothiorelone A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic alkylphenol
1 reference
based on heuristic
inferred from SMILES
mass
380.183503236
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(15S)-acetoxydothiorelone A
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₈O₇
0 references
canonical SMILES
O=C(OC(C)CCCCCC(=O)C=1C(O)=CC(O)=CC1CC(=O)OCC)C
0 references
isomeric SMILES
CCOC(=O)Cc1cc(O)cc(O)c1C(=O)CCCCC[C@@H](C)OC(C)=O
0 references
found in taxon
Diaporthe
1 reference
stated in
Structurally Diverse Polyketides From the Mangrove-Derived Fungus sp. SCSIO 41011 With Their Anti-influenza A Virus Activities
Identifiers
InChI
InChI=1S/C20H28O7/c1-4-26-19(25)11-15-10-16(22)12-18(24)20(15)17(23)9-7-5-6-8-13(2)27-14(3)21/h10,12-13,22,24H,4-9,11H2,1-3H3/t13-/m1/s1
0 references
InChIKey
IBFOIJMFLLVZRV-CYBMUJFWSA-N
0 references
PubChem CID
156581764
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IBFOIJMFLLVZRV-CYBMUJFWSA-N
ChEBI ID
208882
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H28O7/c1-4-26-19(25)11-15-10-16(22)12-18(24)20(15)17(23)9-7-5-6-8-13(2)27-14(3)21/h10,12-13,22,24H,4-9,11H2,1-3H3/t13-/m1/s1
Natural Product Atlas ID
NPA030759
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IBFOIJMFLLVZRV-CYBMUJFWSA-N
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