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(Q105121721)
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English
N-[1-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-17-methyloctadecan-2-yl]docosanamide
group of stereoisomers with the chemical formula C₄₉H₉₆N₂O₉
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
856.7115826520002
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₄₉H₉₆N₂O₉
0 references
canonical SMILES
CCCCCCCCCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(O)C(O)C1NC(C)=O)C(O)C(O)CCCCCCCCCCCCC(C)C
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Identifiers
InChI
InChI=1S/C49H96N2O9/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-27-30-33-36-44(55)51-41(38-59-49-45(50-40(4)53)48(58)47(57)43(37-52)60-49)46(56)42(54)35-32-29-26-23-21-20-22-25-28-31-34-39(2)3/h39,41-43,45-49,52,54,56-58H,5-38H2,1-4H3,(H,50,53)(H,51,55)
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InChIKey
IWMKKWYZKOROBK-UHFFFAOYSA-N
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PubChem CID
85156399
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IWMKKWYZKOROBK-UHFFFAOYSA-N
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