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English
Tetrahydrohalenaquinone B
group of stereoisomers with the chemical formula C₂₀H₂₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
340.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₀O₅
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canonical SMILES
O=C1C=2OCC3C2C(C=4C=C5C(=CC14)C(=O)CCC5O)(C)CCC3O
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isomeric SMILES
C[C@@]12CC[C@H](O)[C@@H]3COC(=C31)C(=O)c1cc3c(cc12)C(O)CCC3=O
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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
New Pentacyclic Compounds from the Okinawan Marine Sponge Xestospongia sapra
Xestospongia
1 reference
stated in
New bioactive halenaquinone derivatives from South Pacific marine sponges of the genus Xestospongia
Identifiers
InChI
InChI=1S/C20H20O5/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/h6-7,12,15-16,22-23H,2-5,8H2,1H3/t12-,15?,16-,20-/m0/s1
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InChIKey
QBIVTXOPBMJYTJ-HLEOHGGJSA-N
0 references
PubChem CID
23427323
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
477408
1 reference
stated in
UniChem
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