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PEDICULARIOSIDE-M;#3;1'-O-BETA-D-(3,4-DIHYDROXY-BETA-PHENYL)-ETHYL-4'-O-FERULOYL-BETA-D-APIOFURANOSYL-(1->3')-ALPHA-L-RHAMNOPYRANOSYL-(1->6')-GLUCOPYRANOSIDE
SpectraBase Compound ID DTM2pVvOBl9
InChI InChI=1S/C35H46O19/c1-16-25(41)26(42)27(43)32(51-16)49-13-23-29(53-24(40)8-5-17-4-7-20(38)22(12-17)47-2)30(54-34-31(45)35(46,14-36)15-50-34)28(44)33(52-23)48-10-9-18-3-6-19(37)21(39)11-18/h3-8,11-12,16,23,25-34,36-39,41-46H,9-10,13-15H2,1-2H3/b8-5+/t16-,23-,25-,26+,27+,28-,29-,30-,31-,32+,33-,34-,35+/m1/s1
InChIKey NCXJQFUHMLGTIE-HQLYMFIXSA-N
Mol Weight 770.7 g/mol
Molecular Formula C35H46O19
Exact Mass 770.263329 g/mol
Enantiomer InChIKey NCXJQFUHMLGTIE-REBLTXOASA-N
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