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SHexCer 46:1;3O
SpectraBase Compound ID 2toMAKpbJeA
InChI InChI=1S/C52H101NO12S/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-41-46(56)51(59)53-44(45(55)40-38-6-4-2)43-63-52-49(58)50(65-66(60,61)62)48(57)47(42-54)64-52/h20-21,44-50,52,54-58H,3-19,22-43H2,1-2H3,(H,53,59)(H,60,61,62)/b21-20-
InChIKey IXOHOUSSAHDTFI-MRCUWXFGNA-N
Mol Weight 964.4 g/mol
Molecular Formula C52H101NO12S
Exact Mass 963.704449 g/mol
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