John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=EEH6QEQMxVO SpectraBase Spectrum ID=29olJW1NhQY

(accessed ).
ASTRASIEVERSIANIN-IX;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-(3'-O-ACETYL)-D-XYLOPYRANOSYL]-6-O-BETA-D-XYLOPYRANOSYL-20(R),24(S)-EPOXYCYCLOARTANE-
SpectraBase Compound ID EEH6QEQMxVO
InChI InChI=1S/C48H78O18/c1-21-30(53)32(55)34(57)40(61-21)65-36-35(62-22(2)49)25(52)19-60-41(36)64-28-11-13-48-20-47(48)15-14-44(7)37(46(9)12-10-29(66-46)43(5,6)58)23(50)17-45(44,8)27(47)16-26(38(48)42(28,3)4)63-39-33(56)31(54)24(51)18-59-39/h21,23-41,50-58H,10-20H2,1-9H3/t21-,23-,24-,25+,26-,27-,28-,29-,30-,31+,32+,33-,34+,35-,36+,37-,38-,39+,40-,41-,44+,45-,46-,47-,48+/m0/s1
InChIKey MWBRLLYGDSLFHT-WSHOFARESA-N
Mol Weight 943.1 g/mol
Molecular Formula C48H78O18
Exact Mass 942.518816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 29olJW1NhQY
Name ASTRASIEVERSIANIN-IX;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-(3'-O-ACETYL)-D-XYLOPYRANOSYL]-6-O-BETA-D-XYLOPYRANOSYL-20(R),24(S)-EPOXYCYCLOARTANE-
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H78O18
InChI InChI=1S/C48H78O18/c1-21-30(53)32(55)34(57)40(61-21)65-36-35(62-22(2)49)25(52)19-60-41(36)64-28-11-13-48-20-47(48)15-14-44(7)37(46(9)12-10-29(66-46)43(5,6)58)23(50)17-45(44,8)27(47)16-26(38(48)42(28,3)4)63-39-33(56)31(54)24(51)18-59-39/h21,23-41,50-58H,10-20H2,1-9H3/t21-,23-,24-,25+,26-,27-,28-,29-,30-,31+,32+,33-,34+,35-,36+,37-,38-,39+,40-,41-,44+,45-,46-,47-,48+/m0/s1
InChIKey MWBRLLYGDSLFHT-WSHOFARESA-N
Literature Reference Author E.BEDIR,I.I.TATLI,I.CALIS,I.A.KHAN
Literature Reference Citation CHEM.PHARM.BULL.,49,1482(2001)
Literature Reference DOI 10.1248/cpb.49.1482
Molecular Weight 943.137 g/mol
Solvent C5D5N
Source File Reference UWVN29081
SpectraBase Batch ID BILnxjPZRne