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(Q104199304)
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English
5,6,11,12,13-Pentahydroxy-4,14-dimethyl-16-oxo-8,17-dioxatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10,12,14-hexaene-3-carbaldehyde
group of stereoisomers with the chemical formula C₁₈H₁₄O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
374.063782028
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₄O₉
0 references
canonical SMILES
O=CC=1C(=C(O)C(O)=C2OC3OC(C(=O)C=4C(=C(O)C(O)=C(O)C43)C)C21)C
0 references
found in taxon
Cacao
1 reference
stated in
Epicoccolides: Antimicrobial and Antifungal Polyketides from an Endophytic FungusEpicoccumsp. Associated withTheobroma cacao
Identifiers
InChI
InChI=1S/C18H14O9/c1-4-6(3-19)8-16-13(23)7-5(2)11(21)14(24)12(22)9(7)18(26-16)27-17(8)15(25)10(4)20/h3,16,18,20-22,24-25H,1-2H3
0 references
InChIKey
VFBCGYVZJVAFIO-UHFFFAOYSA-N
0 references
PubChem CID
78162875
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VFBCGYVZJVAFIO-UHFFFAOYSA-N
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