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2,2',3,3',4',6'-HEXA-O-ACETYL-4,6-O-(2-ETHOXYCARBONYL-PROPYLIDENE)-ALPHA,ALPHA-TREHALOSE

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2,2',3,3',4',6'-HEXA-O-ACETYL-4,6-O-(2-ETHOXYCARBONYL-PROPYLIDENE)-ALPHA,ALPHA-TREHALOSE
SpectraBase Compound ID EAT19WSGtjS
InChI InChI=1S/C30H42O19/c1-9-38-21(37)10-30(8)40-12-20-23(49-30)25(43-16(5)34)27(45-18(7)36)29(47-20)48-28-26(44-17(6)35)24(42-15(4)33)22(41-14(3)32)19(46-28)11-39-13(2)31/h19-20,22-29H,9-12H2,1-8H3/t19-,20-,22-,23-,24+,25+,26-,27-,28-,29-,30?/m1/s1
InChIKey QKKHRFQDXOJBMR-YBVWIMBTSA-N
Mol Weight 706.6 g/mol
Molecular Formula C30H42O19
Exact Mass 706.232029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BHNNywKrx33
Name 2,2',3,3',4',6'-HEXA-O-ACETYL-4,6-O-(2-ETHOXYCARBONYL-PROPYLIDENE)-ALPHA,ALPHA-TREHALOSE
Compound Number 15,STER EOISOMER-#2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42O19
InChI InChI=1S/C30H42O19/c1-9-38-21(37)10-30(8)40-12-20-23(49-30)25(43-16(5)34)27(45-18(7)36)29(47-20)48-28-26(44-17(6)35)24(42-15(4)33)22(41-14(3)32)19(46-28)11-39-13(2)31/h19-20,22-29H,9-12H2,1-8H3/t19-,20-,22-,23-,24+,25+,26-,27-,28-,29-,30?/m1/s1
InChIKey QKKHRFQDXOJBMR-YBVWIMBTSA-N
Literature Reference Author S.CARBONNEL,C.FAYET,J.GELAS
Literature Reference Citation CARBOHYDR.RES.,319,63(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00118-4
Molecular Weight 706.652 g/mol
Solvent CDCl3
Source File Reference UWSW958