Wiley SpectraBase; SpectraBase Compound ID=HYw66YjvBd SpectraBase Spectrum ID=1xrW49jNYYh
http://spectrabase.com/spectrum/1xrW49jNYYh (accessed Aug 12, 2020).

PICFELTARRAENIN-III;11,22-DIOXO-3-ALPHA,16-ALPHA,25-TRIHYDROXY-(20S,24)-EPOXYCUCURBIT-5,23-DIENE-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSIDE;COMPOU
SpectraBase Compound ID HYw66YjvBd
InChI InChI=1S/C42H64O15/c1-18-28(47)31(50)33(56-35-32(51)30(49)29(48)22(17-43)54-35)36(53-18)55-26-13-11-20-19(37(26,2)3)10-12-23-39(6)15-21(44)34(40(39,7)16-25(46)41(20,23)8)42(9)24(45)14-27(57-42)38(4,5)52/h10,14,18,20-23,26,28-36,43-44,47-52H,11-13,15-17H2,1-9H3/t18-,20?,21+,22+,23?,26+,28-,29+,30-,31+,32+,33+,34-,35-,36+,39-,40+,41-,42+/m0/s1
InChIKey OUYNNSYLWQRNAB-CLVRDSCWSA-N
Mol Weight 809 g/mol
Molecular Formula C42H64O15
Exact Mass 808.424522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xrW49jNYYh
SpectraBase Batch ID Ih5DCkuIS5q
Name PICFELTARRAENIN-III;11,22-DIOXO-3-ALPHA,16-ALPHA,25-TRIHYDROXY-(20S,24)-EPOXYCUCURBIT-5,23-DIENE-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSIDE;COMPOU
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H64O15
InChI InChI=1S/C42H64O15/c1-18-28(47)31(50)33(56-35-32(51)30(49)29(48)22(17-43)54-35)36(53-18)55-26-13-11-20-19(37(26,2)3)10-12-23-39(6)15-21(44)34(40(39,7)16-25(46)41(20,23)8)42(9)24(45)14-27(57-42)38(4,5)52/h10,14,18,20-23,26,28-36,43-44,47-52H,11-13,15-17H2,1-9H3/t18-,20?,21+,22+,23?,26+,28-,29+,30-,31+,32+,33+,34-,35-,36+,39-,40+,41-,42+/m0/s1
InChIKey OUYNNSYLWQRNAB-CLVRDSCWSA-N
Literature Reference Author L.HU,Z.CHEN,Y.XIE
Literature Reference Citation J.NAT.PROD.,59,1186(1996)
Literature Reference DOI 10.1021/np9604442
Molecular Weight 808.961 g/mol
Solvent C5D5N
Source File Reference UWKP60
SpectraBase Compound ID HYw66YjvBd