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METHYL{METHYL-3,4-DI-O-ACETYL-2-O-[BENZYL(2,3,4-TRI-O-ACETYL-BETA-D-MANNOPYRANOSYL)URONATE]-ALPHA-D-MANNOPYRANOSIDE}URONATE

View entire compound with spectra: 1 NMR

METHYL{METHYL-3,4-DI-O-ACETYL-2-O-[BENZYL(2,3,4-TRI-O-ACETYL-BETA-D-MANNOPYRANOSYL)URONATE]-ALPHA-D-MANNOPYRANOSIDE}URONATE
SpectraBase Compound ID 4TRsbNvC3Y5
InChI InChI=1S/C31H38O18/c1-14(32)42-20-22(44-16(3)34)26(30(40-7)47-24(20)28(37)39-6)49-31-27(46-18(5)36)23(45-17(4)35)21(43-15(2)33)25(48-31)29(38)41-13-19-11-9-8-10-12-19/h8-12,20-27,30-31H,13H2,1-7H3/t20-,21-,22-,23-,24-,25-,26-,27-,30-,31-/m0/s1
InChIKey MIOVUNKHJBQMKS-YSYFSQQPSA-N
Mol Weight 698.6 g/mol
Molecular Formula C31H38O18
Exact Mass 698.205814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6y2LiBpLM7Y
Name METHYL{METHYL-3,4-DI-O-ACETYL-2-O-[BENZYL(2,3,4-TRI-O-ACETYL-BETA-D-MANNOPYRANOSYL)URONATE]-ALPHA-D-MANNOPYRANOSIDE}URONATE
Comments 9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H38O18
InChI InChI=1S/C31H38O18/c1-14(32)42-20-22(44-16(3)34)26(30(40-7)47-24(20)28(37)39-6)49-31-27(46-18(5)36)23(45-17(4)35)21(43-15(2)33)25(48-31)29(38)41-13-19-11-9-8-10-12-19/h8-12,20-27,30-31H,13H2,1-7H3/t20-,21-,22-,23-,24-,25-,26-,27-,30-,31-/m0/s1
InChIKey MIOVUNKHJBQMKS-YSYFSQQPSA-N
Instrument Name Bruker WM-250
Literature Reference V.I.BETANELI, O.V.BRYUKHANOVA, A.YA.OTT, Z.G.MAKAROVA, N.K.KOCHETKOV (1992)Bioorganich.Khim.(Russ. Lang.): v.18, N6, 802-817.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d