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#9;22-O-METHYL-26-O-BETA-D-GLUCOPYRANOSYL-(25R)-FUROST-5-ENE-3-BETA,22-XI,26-TRIOL-3-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D
SpectraBase Compound ID BJyUEISmQNJ
InChI InChI=1S/C51H84O22/c1-21(19-65-45-41(62)39(60)36(57)31(17-52)69-45)9-14-51(64-6)22(2)33-30(73-51)16-28-26-8-7-24-15-25(10-12-49(24,4)27(26)11-13-50(28,33)5)68-48-44(72-47-42(63)38(59)34(55)23(3)67-47)43(37(58)32(18-53)70-48)71-46-40(61)35(56)29(54)20-66-46/h7,21-23,25-48,52-63H,8-20H2,1-6H3/t21-,22+,23-,25+,26-,27+,28+,29-,30+,31+,32-,33+,34-,35+,36+,37-,38+,39-,40-,41+,42+,43+,44-,45+,46+,47-,48-,49+,50+,51?/m1/s1
InChIKey ANRCURCEMLFKEB-NMHPASMCSA-N
Mol Weight 1049.2 g/mol
Molecular Formula C51H84O22
Exact Mass 1048.545424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4xrUlzkBhHC
Name #9;22-O-METHYL-26-O-BETA-D-GLUCOPYRANOSYL-(25R)-FUROST-5-ENE-3-BETA,22-XI,26-TRIOL-3-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H84O22
InChI InChI=1S/C51H84O22/c1-21(19-65-45-41(62)39(60)36(57)31(17-52)69-45)9-14-51(64-6)22(2)33-30(73-51)16-28-26-8-7-24-15-25(10-12-49(24,4)27(26)11-13-50(28,33)5)68-48-44(72-47-42(63)38(59)34(55)23(3)67-47)43(37(58)32(18-53)70-48)71-46-40(61)35(56)29(54)20-66-46/h7,21-23,25-48,52-63H,8-20H2,1-6H3/t21-,22+,23-,25+,26-,27+,28+,29-,30+,31+,32-,33+,34-,35+,36+,37-,38+,39-,40-,41+,42+,43+,44-,45+,46+,47-,48-,49+,50+,51?/m1/s1
InChIKey ANRCURCEMLFKEB-NMHPASMCSA-N
Literature Reference Author Y.MIMAKI,O.NAKAMURA,Y.SASHIDA,Y.SATOMI,A.NISHINO,H.NISHINO
Literature Reference Citation PHYTOCHEM.,37,227(1994)
Literature Reference DOI 10.1016/0031-9422(94)85030-5
Molecular Weight 1049.215 g/mol
Solvent C5D5N
Source File Reference UWLU23069