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SUBLANCEOSIDE-J2
SpectraBase Compound ID 20Cvg7Wwz4J
InChI InChI=1S/C48H74O18/c1-22-42(51)33(53-7)16-39(58-22)64-43-23(2)59-37(15-30(43)49)65-44-25(4)61-40(18-35(44)55-9)66-45-24(3)60-38(17-34(45)54-8)62-32-14-27-11-12-28-29(47(27,5)19-31(32)50)13-10-26-20-56-48(6)41(26)36(21-57-48)63-46(28)52/h11,20,22-25,28-45,49-51H,10,12-19,21H2,1-9H3/t22-,23-,24+,25+,28-,29+,30+,31-,32-,33+,34-,35-,36-,37+,38-,39+,40+,41-,42-,43-,44-,45+,47+,48+/m1/s1
InChIKey ABYAPVRDBBDAQO-YPEFYTNPSA-N
Mol Weight 939.1 g/mol
Molecular Formula C48H74O18
Exact Mass 938.487516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L7dZRb257cm
Name SUBLANCEOSIDE-J2
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H74O18
InChI InChI=1S/C48H74O18/c1-22-42(51)33(53-7)16-39(58-22)64-43-23(2)59-37(15-30(43)49)65-44-25(4)61-40(18-35(44)55-9)66-45-24(3)60-38(17-34(45)54-8)62-32-14-27-11-12-28-29(47(27,5)19-31(32)50)13-10-26-20-56-48(6)41(26)36(21-57-48)63-46(28)52/h11,20,22-25,28-45,49-51H,10,12-19,21H2,1-9H3/t22-,23-,24+,25+,28-,29+,30+,31-,32-,33+,34-,35-,36-,37+,38-,39+,40+,41-,42-,43-,44-,45+,47+,48+/m1/s1
InChIKey ABYAPVRDBBDAQO-YPEFYTNPSA-N
Literature Reference Author T.WARASHINA,T.NORO
Literature Reference Citation CHEM.PHARM.BULL.,54,1551(2006)
Literature Reference DOI 10.1248/cpb.54.1551
Molecular Weight 939.105 g/mol
Sample ID 55392
Solvent C5D5N