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(Q105160924)
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English
(2,12,14-Triacetyloxy-8-chloro-3-hydroxy-4,13-dimethyl-9,17-dimethylidene-5-oxo-6-oxatricyclo[11.4.0.03,7]heptadec-10-en-15-yl) acetate
group of stereoisomers with the chemical formula C₂₈H₃₅ClO₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
briarane diterpenoid
1 reference
inferred from
briarane diterpenoid
mass
582.1867896199998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₃₅ClO₁₁
0 references
canonical SMILES
O=C(OC1C=CC(=C)C(Cl)C2OC(=O)C(C)C2(O)C(OC(=O)C)C3C(=C)CC(OC(=O)C)C(OC(=O)C)C13C)C
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Identifiers
InChI
InChI=1S/C28H35ClO11/c1-12-9-10-20(37-16(5)31)27(8)21(13(2)11-19(36-15(4)30)23(27)38-17(6)32)24(39-18(7)33)28(35)14(3)26(34)40-25(28)22(12)29/h9-10,14,19-25,35H,1-2,11H2,3-8H3
0 references
InChIKey
MBRBCPOVEZYRKS-UHFFFAOYSA-N
0 references
PubChem CID
162852591
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MBRBCPOVEZYRKS-UHFFFAOYSA-N
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