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(24S,25S)-24-[(BETA-D-GLUCOPYRANOSYL)-OXY]-2-ALPHA-HYDROXYSPIROST-5-EN-3-BETA-YL-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[B
SpectraBase Compound ID Dct2d4ZCqRp
InChI InChI=1S/C62H100O34/c1-20-18-84-62(12-30(20)86-55-46(79)42(75)38(71)31(13-63)87-55)21(2)36-29(96-62)10-25-23-6-5-22-9-28(26(68)11-61(22,4)24(23)7-8-60(25,36)3)85-56-48(81)44(77)50(35(17-67)91-56)92-59-53(52(41(74)34(16-66)90-59)94-54-45(78)37(70)27(69)19-83-54)95-58-49(82)51(40(73)33(15-65)89-58)93-57-47(80)43(76)39(72)32(14-64)88-57/h5,20-21,23-59,63-82H,6-19H2,1-4H3/t20?,21-,23+,24-,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-,52-,53+,54+,55-,56-,57-,58-,59-,60-,61-,62+/m0/s1
InChIKey RYVMUASDIZQXAA-BEEQKMAUSA-N
Mol Weight 1389.4 g/mol
Molecular Formula C62H100O34
Exact Mass 1388.6096 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1tXbkoytwfK
Name (24S,25S)-24-[(BETA-D-GLUCOPYRANOSYL)-OXY]-2-ALPHA-HYDROXYSPIROST-5-EN-3-BETA-YL-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[B
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H100O34
InChI InChI=1S/C62H100O34/c1-20-18-84-62(12-30(20)86-55-46(79)42(75)38(71)31(13-63)87-55)21(2)36-29(96-62)10-25-23-6-5-22-9-28(26(68)11-61(22,4)24(23)7-8-60(25,36)3)85-56-48(81)44(77)50(35(17-67)91-56)92-59-53(52(41(74)34(16-66)90-59)94-54-45(78)37(70)27(69)19-83-54)95-58-49(82)51(40(73)33(15-65)89-58)93-57-47(80)43(76)39(72)32(14-64)88-57/h5,20-21,23-59,63-82H,6-19H2,1-4H3/t20?,21-,23+,24-,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-,52-,53+,54+,55-,56-,57-,58-,59-,60-,61-,62+/m0/s1
InChIKey RYVMUASDIZQXAA-BEEQKMAUSA-N
Literature Reference Author Y.MIMAKI,K.WATANABE,H.SAKAGAMI,Y.SASHIDA
Literature Reference Citation J.NAT.PROD.,65,1863(2002)
Literature Reference DOI 10.1021/np020276f
Molecular Weight 1389.456 g/mol
Solvent C5D5N
Source File Reference UWSI16510