DEACYLMETAPLEXIGENIN-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE]

SpectraBase Compound ID	B9TSw5m9ezX
InChI	InChI=1S/C46H74O18/c1-21-38(52)31(56-8)19-37(57-21)64-41-24(4)60-36(18-30(41)50)63-40-23(3)59-35(17-29(40)49)62-39-22(2)58-34(16-28(39)48)61-27-10-11-42(6)26(15-27)9-12-45(54)32(42)20-33(51)43(7)44(53,25(5)47)13-14-46(43,45)55/h9,21-24,27-41,48-55H,10-20H2,1-8H3/t21-,22-,23-,24-,27-,28+,29+,30+,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,41-,42-,43+,44+,45-,46+/m0/s1
InChIKey	FORLSKLHKCAOBW-NUOSQLMASA-N Google Search
Mol Weight	915.1 g/mol
Molecular Formula	C46H74O18
Exact Mass	914.487516 g/mol

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SpectraBase Spectrum ID	GRgsyj5fqLp
Name	DEACYLMETAPLEXIGENIN-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE]
Compound Number	8
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C46H74O18
InChI	InChI=1S/C46H74O18/c1-21-38(52)31(56-8)19-37(57-21)64-41-24(4)60-36(18-30(41)50)63-40-23(3)59-35(17-29(40)49)62-39-22(2)58-34(16-28(39)48)61-27-10-11-42(6)26(15-27)9-12-45(54)32(42)20-33(51)43(7)44(53,25(5)47)13-14-46(43,45)55/h9,21-24,27-41,48-55H,10-20H2,1-8H3/t21-,22-,23-,24-,27-,28+,29+,30+,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,41-,42-,43+,44+,45-,46+/m0/s1
InChIKey	FORLSKLHKCAOBW-NUOSQLMASA-N
Literature Reference Author	T.WARASHINA,T.NORO
Literature Reference Citation	PHYTOCHEM.,53,485(2000)
Literature Reference DOI	10.1016/S0031-9422(99)00560-9
Molecular Weight	915.083 g/mol
Solvent	C5D5N
Source File Reference	UWLU2042