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Uzarigenin-3.beta.-O-Canaroside
SpectraBase Compound ID Am7q3RXaH7P
InChI InChI=1S/C29H44O7/c1-16-26(32)23(30)14-25(35-16)36-19-6-9-27(2)18(13-19)4-5-22-21(27)7-10-28(3)20(8-11-29(22,28)33)17-12-24(31)34-15-17/h12,16,18-23,25-26,30,32-33H,4-11,13-15H2,1-3H3/t16-,18+,19+,20-,21?,22?,23-,25+,26-,27+,28-,29+/m1/s1
InChIKey NQOMDNMTNVQXRR-RMMRGCIOSA-N
Mol Weight 504.7 g/mol
Molecular Formula C29H44O7
Exact Mass 504.308704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJJWeCUiM0h
Name Uzarigenin-3.beta.-O-Canaroside
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H44O7
InChI InChI=1S/C29H44O7/c1-16-26(32)23(30)14-25(35-16)36-19-6-9-27(2)18(13-19)4-5-22-21(27)7-10-28(3)20(8-11-29(22,28)33)17-12-24(31)34-15-17/h12,16,18-23,25-26,30,32-33H,4-11,13-15H2,1-3H3/t16-,18+,19+,20-,21?,22?,23-,25+,26-,27+,28-,29+/m1/s1
InChIKey NQOMDNMTNVQXRR-RMMRGCIOSA-N
Molecular Weight 504.664 g/mol
SMILES O[C@]1([C@@]([C@](O[C@@](O[C@]2(CC[C@@]3(C4CC[C@]5([C@](CC[C@@]5(C5=CC(=O)OC5)[H])(C4CC[C@]3(C2)[H])O)C)C)[H])(C1)[H])(C)[H])(O)[H])[H]
SPLASH splash10-0kar-0539000000-8e9190582a50e95048f2
Source of Spectrum X2-53-169-1
Synonyms Uzarigenin-3.beta.-O-Digitoxoside
Wiley ID 1603387