John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=IxTD58cjZPz SpectraBase Spectrum ID=2BMYH8XurSs

(accessed ).
16,17-DIHYDRO-NERIDIENONE-3-O-BETA-D-GLUCOPYRANOSYL-(1->6)-O-BETA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID IxTD58cjZPz
InChI InChI=1S/C35H52O14/c1-33-8-5-18(47-32-30(43)28(41)26(39)23(49-32)15-46-31-29(42)27(40)25(38)22(13-36)48-31)12-17(33)3-4-21-20(33)6-9-34(2)19(7-10-35(21,34)44)16-11-24(37)45-14-16/h7,11,17-18,20-23,25-32,36,38-44H,3-6,8-10,12-15H2,1-2H3/t17-,18+,20?,21?,22-,23-,25-,26+,27+,28+,29-,30-,31-,32-,33+,34-,35+/m1/s1
InChIKey IGQVDHJWLPOLPN-YULYMQONSA-N
Mol Weight 696.8 g/mol
Molecular Formula C35H52O14
Exact Mass 696.335707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2BMYH8XurSs
Name 16,17-DIHYDRO-NERIDIENONE-3-O-BETA-D-GLUCOPYRANOSYL-(1->6)-O-BETA-D-GALACTOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H52O14
InChI InChI=1S/C35H52O14/c1-33-8-5-18(47-32-30(43)28(41)26(39)23(49-32)15-46-31-29(42)27(40)25(38)22(13-36)48-31)12-17(33)3-4-21-20(33)6-9-34(2)19(7-10-35(21,34)44)16-11-24(37)45-14-16/h7,11,17-18,20-23,25-32,36,38-44H,3-6,8-10,12-15H2,1-2H3/t17-,18+,20?,21?,22-,23-,25-,26+,27+,28+,29-,30-,31-,32-,33+,34-,35+/m1/s1
InChIKey IGQVDHJWLPOLPN-YULYMQONSA-N
Literature Reference Author R.N.YADAV,K.RATHORE
Literature Reference Citation FITOTERAPIA,72,459(2001)
Literature Reference DOI 10.1016/S0367-326X(00)00337-3
Molecular Weight 696.789 g/mol
Solvent CDCl3
Source File Reference UWVN4043
SpectraBase Batch ID GpE1OVZvN8s