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SQUARROSIDE-A;3-O-BETA-[GALACTOPYRANOSYL-(1->2)-[XYLOPYRANOSYL-(1->3)]-GLUCURONOPYRANOSYL]-GYPSOGENIN-28-O-XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1-
SpectraBase Compound ID ILdOTtTpqGz
InChI InChI=1S/C71H110O36/c1-26-50(101-58-44(84)38(78)31(76)23-93-58)43(83)48(88)60(95-26)106-56-54(104-61-46(86)41(81)34(22-73)99-61)51(97-28(3)75)27(2)96-63(56)107-65(92)71-18-16-66(4,5)20-30(71)29-10-11-36-67(6)14-13-37(68(7,25-74)35(67)12-15-70(36,9)69(29,8)17-19-71)100-64-55(105-62-47(87)42(82)40(80)33(21-72)98-62)52(49(89)53(103-64)57(90)91)102-59-45(85)39(79)32(77)24-94-59/h10,25-27,30-56,58-64,72-73,76-89H,11-24H2,1-9H3,(H,90,91)/t26-,27+,30?,31-,32-,33+,34-,35?,36?,37-,38+,39+,40-,41-,42-,43-,44-,45-,46+,47+,48+,49+,50-,51-,52+,53+,54-,55-,56+,58+,59+,60-,61-,62-,63-,64-,67-,68-,69+,70+,71-/m0/s1
InChIKey HXYTVNHXQDFALL-ORWIKMBGSA-N
Mol Weight 1539.6 g/mol
Molecular Formula C71H110O36
Exact Mass 1538.67768 g/mol
Enantiomer InChIKey HXYTVNHXQDFALL-NDBOWANPSA-N
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