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PENNOGENIN-3-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSIDE]
SpectraBase Compound ID orKFomScF4
InChI InChI=1S/C45H72O18/c1-19-8-13-44(56-18-19)21(3)45(55)29(63-44)15-26-24-7-6-22-14-23(9-11-42(22,4)25(24)10-12-43(26,45)5)58-41-38(62-39-35(53)33(51)30(48)20(2)57-39)37(32(50)28(17-47)60-41)61-40-36(54)34(52)31(49)27(16-46)59-40/h6,19-21,23-41,46-55H,7-18H2,1-5H3/t19-,20+,21+,23-,24+,25-,26-,27+,28+,29-,30+,31-,32+,33-,34-,35-,36+,37-,38+,39+,40-,41+,42-,43-,44-,45+/m0/s1
InChIKey CECFADWCOVINPQ-QMSYFXENSA-N
Mol Weight 901.1 g/mol
Molecular Formula C45H72O18
Exact Mass 900.471865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87dDfqssskv
Name PENNOGENIN-3-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSIDE]
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H72O18
InChI InChI=1S/C45H72O18/c1-19-8-13-44(56-18-19)21(3)45(55)29(63-44)15-26-24-7-6-22-14-23(9-11-42(22,4)25(24)10-12-43(26,45)5)58-41-38(62-39-35(53)33(51)30(48)20(2)57-39)37(32(50)28(17-47)60-41)61-40-36(54)34(52)31(49)27(16-46)59-40/h6,19-21,23-41,46-55H,7-18H2,1-5H3/t19-,20+,21+,23-,24+,25-,26-,27+,28+,29-,30+,31-,32+,33-,34-,35-,36+,37-,38+,39+,40-,41+,42-,43-,44-,45+/m0/s1
InChIKey CECFADWCOVINPQ-QMSYFXENSA-N
Literature Reference Author Y.MIMAKI,O.NAKAMURA,Y.SASHIDA,T.NIKAIDO,T.OHMOTO
Literature Reference Citation PHYTOCHEM.,38,1279(1995)
Literature Reference DOI 10.1016/0031-9422(94)00790-Z
Molecular Weight 901.056 g/mol
Solvent C5D5N
Source File Reference UWMS3971