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#4;CLEMATIUNICINOSIDE-D;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-D-RIBOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSYL-OLEAN-12-EN-28-OIC-AC

View entire compound with spectra: 1 NMR

#4;CLEMATIUNICINOSIDE-D;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-D-RIBOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSYL-OLEAN-12-EN-28-OIC-AC
SpectraBase Compound ID ECIexo6GK8r
InChI InChI=1S/C70H114O34/c1-26-38(74)44(80)49(85)59(94-26)101-54-32(22-72)97-57(52(88)47(54)83)92-24-33-42(78)46(82)51(87)61(99-33)104-64(90)70-18-16-65(3,4)20-29(70)28-10-11-36-67(7)14-13-37(66(5,6)35(67)12-15-69(36,9)68(28,8)17-19-70)100-63-56(40(76)30(73)23-91-63)103-62-53(89)55(39(75)27(2)95-62)102-58-48(84)43(79)34(25-93-58)98-60-50(86)45(81)41(77)31(21-71)96-60/h10,26-27,29-63,71-89H,11-25H2,1-9H3/t26-,27+,29+,30-,31-,32-,33-,34-,35+,36-,37+,38-,39+,40+,41-,42-,43-,44+,45+,46+,47-,48-,49+,50-,51-,52-,53-,54-,55-,56-,57-,58+,59-,60+,61+,62+,63+,67+,68-,69-,70+/m1/s1
InChIKey COIHWEMJSUDENE-BWNPJDLMSA-N
Mol Weight 1499.6 g/mol
Molecular Formula C70H114O34
Exact Mass 1498.719151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2mvaXv3Bz8y
Name #4;CLEMATIUNICINOSIDE-D;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-D-RIBOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSYL-OLEAN-12-EN-28-OIC-AC
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C70H114O34
InChI InChI=1S/C70H114O34/c1-26-38(74)44(80)49(85)59(94-26)101-54-32(22-72)97-57(52(88)47(54)83)92-24-33-42(78)46(82)51(87)61(99-33)104-64(90)70-18-16-65(3,4)20-29(70)28-10-11-36-67(7)14-13-37(66(5,6)35(67)12-15-69(36,9)68(28,8)17-19-70)100-63-56(40(76)30(73)23-91-63)103-62-53(89)55(39(75)27(2)95-62)102-58-48(84)43(79)34(25-93-58)98-60-50(86)45(81)41(77)31(21-71)96-60/h10,26-27,29-63,71-89H,11-25H2,1-9H3/t26-,27+,29+,30-,31-,32-,33-,34-,35+,36-,37+,38-,39+,40+,41-,42-,43-,44+,45+,46+,47-,48-,49+,50-,51-,52-,53-,54-,55-,56-,57-,58+,59-,60+,61+,62+,63+,67+,68-,69-,70+/m1/s1
InChIKey COIHWEMJSUDENE-BWNPJDLMSA-N
Literature Reference Author S.G.LI,X.J.HUANG,M.M.LI,M.WANG,R.B.FENG,W.ZHANG,Y.L.LI,Y.WAN G,W.C.YE
Literature Reference Citation CHEM.PHARM.BULL.,62,35(2014)
Literature Reference DOI 10.1248/cpb.c13-00269
Molecular Weight 1499.655 g/mol
Solvent C5D5N
Source File Reference UWBT13809