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3-BETA,21,24-TRIHYDROXY-21,23;22,28;26,28-TRIEPOXY-5-ALPHA-STIGMASTA-8(9),14(15)-DIEN-3-O-BETA-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID F6YCGmIjX7t
InChI InChI=1S/C41H62O16/c1-17-16-51-40(4)41(17,50)34-32(57-40)26(35(49)56-34)23-8-7-21-20-6-5-18-13-19(9-11-38(18,2)22(20)10-12-39(21,23)3)52-37-33(30(47)28(45)25(15-43)54-37)55-36-31(48)29(46)27(44)24(14-42)53-36/h7,17-19,23-37,42-50H,5-6,8-16H2,1-4H3/t17-,18?,19-,23+,24+,25+,26?,27-,28+,29-,30-,31+,32+,33+,34-,35-,36-,37+,38-,39-,40-,41?/m0/s1
InChIKey XXHCZXMNBAXGQV-UTRSOZNHSA-N
Mol Weight 810.9 g/mol
Molecular Formula C41H62O16
Exact Mass 810.403786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Idmqphw5o3a
Name 3-BETA,21,24-TRIHYDROXY-21,23;22,28;26,28-TRIEPOXY-5-ALPHA-STIGMASTA-8(9),14(15)-DIEN-3-O-BETA-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H62O16
InChI InChI=1S/C41H62O16/c1-17-16-51-40(4)41(17,50)34-32(57-40)26(35(49)56-34)23-8-7-21-20-6-5-18-13-19(9-11-38(18,2)22(20)10-12-39(21,23)3)52-37-33(30(47)28(45)25(15-43)54-37)55-36-31(48)29(46)27(44)24(14-42)53-36/h7,17-19,23-37,42-50H,5-6,8-16H2,1-4H3/t17-,18?,19-,23+,24+,25+,26?,27-,28+,29-,30-,31+,32+,33+,34-,35-,36-,37+,38-,39-,40-,41?/m0/s1
InChIKey XXHCZXMNBAXGQV-UTRSOZNHSA-N
Literature Reference Author G.CIOFFI,R.SANOGO,D.DIALLO,G.ROMUSSI,N.D.TOMMASI
Literature Reference Citation J.NAT.PROD.,67,389(2004)
Literature Reference DOI 10.1021/np030337p
Molecular Weight 810.934 g/mol
Solvent CD3OD
Source File Reference UWKP4227