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3-O-[.alpha.-L-Arabinopyranosyl-(1->2).beta.-D-glucopyranosyl]-bayogenin-28-[.beta.-D-xylopyranosyl-(1->3)-A-L-rhamnopyranosb
SpectraBase Compound ID LSfYjwnFrQj
InChI InChI=1S/C57H92O26/c1-23-33(64)42(79-46-39(70)34(65)27(61)19-74-46)41(72)48(77-23)81-43-36(67)29(63)21-76-49(43)83-51(73)57-14-12-52(2,3)16-25(57)24-8-9-32-53(4)17-26(60)45(54(5,22-59)31(53)10-11-56(32,7)55(24,6)13-15-57)82-50-44(38(69)37(68)30(18-58)78-50)80-47-40(71)35(66)28(62)20-75-47/h8,23,25-50,58-72H,9-22H2,1-7H3/t23?,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?,53?,54?,55+,56?,57-/m1/s1
InChIKey RKZQVMCDWBGFHM-ZILABJHRSA-N
Mol Weight 1193.3 g/mol
Molecular Formula C57H92O26
Exact Mass 1192.587683 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AMfNTAiYPzl
Name 3-O-[.alpha.-L-Arabinopyranosyl-(1->2).beta.-D-glucopyranosyl]-bayogenin-28-[.beta.-D-xylopyranosyl-(1->3)-A-L-rhamnopyranosb
Comments C/H - shift correlation
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C57H92O26
InChI InChI=1S/C57H92O26/c1-23-33(64)42(79-46-39(70)34(65)27(61)19-74-46)41(72)48(77-23)81-43-36(67)29(63)21-76-49(43)83-51(73)57-14-12-52(2,3)16-25(57)24-8-9-32-53(4)17-26(60)45(54(5,22-59)31(53)10-11-56(32,7)55(24,6)13-15-57)82-50-44(38(69)37(68)30(18-58)78-50)80-47-40(71)35(66)28(62)20-75-47/h8,23,25-50,58-72H,9-22H2,1-7H3/t23?,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?,53?,54?,55+,56?,57-/m1/s1
InChIKey RKZQVMCDWBGFHM-ZILABJHRSA-N
Instrument Name SF = 400 MHz
Literature Reference Phytochem. 27, 1439 (1988).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Pyridine-D5