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ARALIA-SAPONIN-V;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-
SpectraBase Compound ID HTvw0fad8Eb
InChI InChI=1S/C54H88O23/c1-49(2)14-16-54(48(69)77-46-41(68)38(65)34(61)27(21-57)72-46)17-15-52(6)23(24(54)18-49)8-9-30-51(5)12-11-31(50(3,4)29(51)10-13-53(30,52)7)74-47-43(76-45-40(67)37(64)33(60)26(20-56)71-45)42(35(62)28(22-58)73-47)75-44-39(66)36(63)32(59)25(19-55)70-44/h8,24-47,55-68H,9-22H2,1-7H3/t24?,25-,26+,27-,28-,29?,30?,31+,32-,33+,34-,35-,36+,37-,38+,39-,40+,41-,42+,43-,44+,45-,46+,47+,51+,52-,53-,54+/m1/s1
InChIKey MROYUZKXUGPCPD-RDXHGIRMSA-N
Mol Weight 1105.3 g/mol
Molecular Formula C54H88O23
Exact Mass 1104.571639 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5As5Pay1WbG
Name ARALIA-SAPONIN-V;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H88O23
InChI InChI=1S/C54H88O23/c1-49(2)14-16-54(48(69)77-46-41(68)38(65)34(61)27(21-57)72-46)17-15-52(6)23(24(54)18-49)8-9-30-51(5)12-11-31(50(3,4)29(51)10-13-53(30,52)7)74-47-43(76-45-40(67)37(64)33(60)26(20-56)71-45)42(35(62)28(22-58)73-47)75-44-39(66)36(63)32(59)25(19-55)70-44/h8,24-47,55-68H,9-22H2,1-7H3/t24?,25-,26+,27-,28-,29?,30?,31+,32-,33+,34-,35-,36+,37-,38+,39-,40+,41-,42+,43-,44+,45-,46+,47+,51+,52-,53-,54+/m1/s1
InChIKey MROYUZKXUGPCPD-RDXHGIRMSA-N
Literature Reference Author S.J.SONG,N.NAKAMURA,C.M.MA,M.HATTORI,S.X.XU
Literature Reference Citation PHYTOCHEM.,56,491(2001)
Literature Reference DOI 10.1016/S0031-9422(00)00379-4
Molecular Weight 1105.279 g/mol
Solvent Unknown
Source File Reference UWVN1807