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(Q104201156)
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English
[12-But-2-en-2-yl-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3,9-dimethyl-2,6-dioxo-1-oxacyclododeca-3,9-dien-7-yl] 3-methylbutanoate
group of stereoisomers with the chemical formula C₂₇H₄₀O₁₀
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Statements
instance of
group of stereoisomers
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subclass of
macrolides
1 reference
inferred from
macrolides
mass
524.2621474799997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₄₀O₁₀
0 references
canonical SMILES
O=C1OC(C(=CC)C)CC=C(C)C(OC2OC(CO)C(O)C2O)C(OC(=O)CC(C)C)C(=O)CC=C1C
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Identifiers
InChI
InChI=1S/C27H40O10/c1-7-15(4)19-11-9-16(5)24(37-27-23(32)22(31)20(13-28)35-27)25(36-21(30)12-14(2)3)18(29)10-8-17(6)26(33)34-19/h7-9,14,19-20,22-25,27-28,31-32H,10-13H2,1-6H3
0 references
InChIKey
XNEJFSCXUANVQT-UHFFFAOYSA-N
0 references
PubChem CID
163029807
1 reference
based on heuristic
inferred from InChIKey
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