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VANICOSIDE-A
SpectraBase Compound ID GVXhE1fruoD
InChI InChI=1S/C51H50O21/c1-29(52)68-48-47(63)45(61)39(26-65-42(58)23-13-33-9-20-37(56)38(25-33)64-2)69-50(48)72-51(28-67-43(59)22-11-31-5-16-35(54)17-6-31)49(70-44(60)24-12-32-7-18-36(55)19-8-32)46(62)40(71-51)27-66-41(57)21-10-30-3-14-34(53)15-4-30/h3-25,39-40,45-50,53-56,61-63H,26-28H2,1-2H3/b21-10+,22-11+,23-13+,24-12+/t39-,40-,45-,46-,47+,48-,49+,50-,51+/m1/s1
InChIKey RNXDQKHOEWIRNH-MNQPQWAHSA-N
Mol Weight 998.9 g/mol
Molecular Formula C51H50O21
Exact Mass 998.284459 g/mol
Enantiomer InChIKey RNXDQKHOEWIRNH-TZRINHGJSA-N
Unknown Identification

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