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BESYSAPONIN-C12
SpectraBase Compound ID 3jATktpCwGn
InChI InChI=1S/C53H86O22/c1-21-31(58)34(61)38(65)45(69-21)74-42-26(55)17-49(6)28(50(42,7)20-54)12-13-51(8)29(49)11-10-24-25-16-48(4,5)14-15-53(25,30(57)18-52(24,51)9)47(67)75-46-41(35(62)32(59)22(2)70-46)73-44-39(66)36(63)40(23(3)71-44)72-43-37(64)33(60)27(56)19-68-43/h10,21-23,25-46,54-66H,11-20H2,1-9H3/t21-,22+,23-,25?,26-,27-,28?,29?,30+,31-,32-,33+,34+,35-,36-,37-,38+,39+,40-,41+,42-,43+,44-,45-,46-,49-,50-,51+,52+,53+/m0/s1
InChIKey JDDNPFYPOOCZHR-VGCCHDFWSA-N
Mol Weight 1075.2 g/mol
Molecular Formula C53H86O22
Exact Mass 1074.561074 g/mol
Enantiomer InChIKey JDDNPFYPOOCZHR-IWWJJEPZSA-N
Unknown Identification

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