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VANICOSIDE-B
SpectraBase Compound ID LBW0abloTXX
InChI InChI=1S/C49H48O20/c1-62-36-24-31(8-19-35(36)53)12-22-40(55)63-25-37-43(58)45(60)46(61)48(66-37)69-49(27-65-41(56)21-10-29-4-15-33(51)16-5-29)47(67-42(57)23-11-30-6-17-34(52)18-7-30)44(59)38(68-49)26-64-39(54)20-9-28-2-13-32(50)14-3-28/h2-24,37-38,43-48,50-53,58-61H,25-27H2,1H3/b20-9+,21-10+,22-12+,23-11+/t37-,38-,43-,44-,45+,46-,47+,48-,49+/m1/s1
InChIKey ALSDWGAQQGXOHC-PWYSLETCSA-N
Mol Weight 956.9 g/mol
Molecular Formula C49H48O20
Exact Mass 956.273894 g/mol
Enantiomer InChIKey ALSDWGAQQGXOHC-MXOBQARTSA-N
Unknown Identification

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