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#1;(25R,26R)-26-METHOXY-SPIROST-5-EN-3-BETA-OL-3-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[6-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSIDE]
SpectraBase Compound ID 6jJM0WychPW
InChI InChI=1S/C48H76O19/c1-20-10-15-48(67-42(20)58-7)21(2)32-29(66-48)17-28-26-9-8-24-16-25(11-13-46(24,5)27(26)12-14-47(28,32)6)61-45-41(65-43-37(55)35(53)33(51)22(3)60-43)39(57)40(30(18-49)62-45)64-44-38(56)36(54)34(52)31(63-44)19-59-23(4)50/h8,20-22,25-45,49,51-57H,9-19H2,1-7H3/t20-,21+,22+,25+,26-,27+,28+,29+,30-,31-,32+,33+,34-,35-,36+,37-,38-,39+,40-,41-,42+,43+,44+,45-,46+,47+,48+/m1/s1
InChIKey HOLQVKHMRPVKIZ-LFLZMPDASA-N
Mol Weight 957.1 g/mol
Molecular Formula C48H76O19
Exact Mass 956.49808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IIuQ7bZY6Eh
Name #1;(25R,26R)-26-METHOXY-SPIROST-5-EN-3-BETA-OL-3-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[6-O-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSIDE]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H76O19
InChI InChI=1S/C48H76O19/c1-20-10-15-48(67-42(20)58-7)21(2)32-29(66-48)17-28-26-9-8-24-16-25(11-13-46(24,5)27(26)12-14-47(28,32)6)61-45-41(65-43-37(55)35(53)33(51)22(3)60-43)39(57)40(30(18-49)62-45)64-44-38(56)36(54)34(52)31(63-44)19-59-23(4)50/h8,20-22,25-45,49,51-57H,9-19H2,1-7H3/t20-,21+,22+,25+,26-,27+,28+,29+,30-,31-,32+,33+,34-,35-,36+,37-,38-,39+,40-,41-,42+,43+,44+,45-,46+,47+,48+/m1/s1
InChIKey HOLQVKHMRPVKIZ-LFLZMPDASA-N
Literature Reference Author O.NAKAMURA,Y.MIMAKI,H.NISHINO,Y.SASHIDA
Literature Reference Citation PHYTOCHEM.,36,463(1994)
Literature Reference DOI 10.1016/S0031-9422(00)97096-1
Molecular Weight 957.120 g/mol
Solvent C5D5N
Source File Reference UWMS25243