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CARDENOLIDE_N-1;3-BETA-O-(BETA-D-SARMENTOSYL)-14-HYDROXY-5-ALPHA,14-BETA-CARD-20-(22)-ENOLIDE
SpectraBase Compound ID IuedOhM85tR
InChI InChI=1S/C30H46O7/c1-17-27(32)24(34-4)15-26(36-17)37-20-7-10-28(2)19(14-20)5-6-23-22(28)8-11-29(3)21(9-12-30(23,29)33)18-13-25(31)35-16-18/h13,17,19-24,26-27,32-33H,5-12,14-16H2,1-4H3/t17-,19-,20+,21-,22+,23-,24+,26+,27+,28+,29-,30+/m1/s1
InChIKey YBZZSZQZDODUAA-NOGJFSSHSA-N
Mol Weight 518.7 g/mol
Molecular Formula C30H46O7
Exact Mass 518.324354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7wsQCRcEHB3
Name CARDENOLIDE_N-1;3-BETA-O-(BETA-D-SARMENTOSYL)-14-HYDROXY-5-ALPHA,14-BETA-CARD-20-(22)-ENOLIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O7
InChI InChI=1S/C30H46O7/c1-17-27(32)24(34-4)15-26(36-17)37-20-7-10-28(2)19(14-20)5-6-23-22(28)8-11-29(3)21(9-12-30(23,29)33)18-13-25(31)35-16-18/h13,17,19-24,26-27,32-33H,5-12,14-16H2,1-4H3/t17-,19-,20+,21-,22+,23-,24+,26+,27+,28+,29-,30+/m1/s1
InChIKey YBZZSZQZDODUAA-NOGJFSSHSA-N
Literature Reference Author M.ZHAO,L.BAI,L.WANG,A.TOKI,T.HASEGAWA,M.KIKUCHI,M.ABE,J.I.SA KAI,R.HASEGAWA,Y.BAI
Literature Reference Citation J.NAT.PROD.,70,1098(2007)
Literature Reference DOI 10.1021/np068066g
Molecular Weight 518.691 g/mol
Sample ID 30572
Solvent CDCl3