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12-O-NICOTINOYLLINEOLON-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE]
SpectraBase Compound ID 7lvlqoPkBhD
InChI InChI=1S/C52H77NO18/c1-25(54)33-13-16-52(61)50(33,7)39(68-48(59)30-10-9-17-53-24-30)23-38-49(6)14-12-32(18-31(49)11-15-51(38,52)60)67-40-19-34(55)45(27(3)64-40)69-41-20-35(56)46(28(4)65-41)70-42-21-36(57)47(29(5)66-42)71-43-22-37(62-8)44(58)26(2)63-43/h9-11,17,24,26-29,32-47,55-58,60-61H,12-16,18-23H2,1-8H3/t26-,27-,28-,29-,32-,33-,34+,35+,36+,37-,38+,39+,40+,41+,42+,43+,44-,45-,46-,47-,49-,50-,51-,52+/m0/s1
InChIKey LAGSYIHWUWLKLY-QKROFAMYSA-N
Mol Weight 1004.2 g/mol
Molecular Formula C52H77NO18
Exact Mass 1003.514065 g/mol
Enantiomer InChIKey LAGSYIHWUWLKLY-XZDXYNEISA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Steroidal glycosides from the aerial part of Asclepias incarnata Phytochemistry 2000
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