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Halenaquinol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
334.084123548
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₄O₅
0 references
canonical SMILES
O=C1C=2OC=C3C(=O)CCC(C4=CC=5C(O)=CC=C(O)C5C=C14)(C23)C
0 references
isomeric SMILES
C[C@@]12CCC(=O)c3coc(c31)C(=O)c1cc3c(O)ccc(O)c3cc12
0 references
found in taxon
Neopetrosia carbonaria
1 reference
stated in
Protein tyrosine kinase inhibitory properties of planar polycyclics obtained from the marine sponge Xestospongia cf. carbonaria and from total synthesis
Neopetrosia sapra
1 reference
stated in
Halenaquinol and halenaquinol sulfate, pentacyclic hydroquinones from the Okinawan marine sponge Xestospongia sapra.
Identifiers
InChI
InChI=1S/C20H14O5/c1-20-5-4-16(23)12-8-25-19(17(12)20)18(24)11-6-9-10(7-13(11)20)15(22)3-2-14(9)21/h2-3,6-8,21-22H,4-5H2,1H3/t20-/m0/s1
0 references
InChIKey
WXLYRCGVTYXHMS-FQEVSTJZSA-N
0 references
PubChem CID
9996986
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WXLYRCGVTYXHMS-FQEVSTJZSA-N
UniChem compound ID
321460
1 reference
stated in
UniChem
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