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2-BENZYLOXYCARBONYLAMINOETHYL 2,4,6-TRI-O-BENZYL-3-O-(2-O-ALLYL-3,4,6-TRI-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-D-MANNOPYRANOSIDE
SpectraBase Compound ID HRxQsToTX6N
InChI InChI=1S/C67H73NO13/c1-2-39-72-63-61(76-45-54-32-18-7-19-33-54)59(74-43-52-28-14-5-15-29-52)57(48-70-41-50-24-10-3-11-25-50)80-66(63)81-62-60(75-44-53-30-16-6-17-31-53)58(49-71-42-51-26-12-4-13-27-51)79-65(64(62)77-46-55-34-20-8-21-35-55)73-40-38-68-67(69)78-47-56-36-22-9-23-37-56/h2-37,57-66H,1,38-49H2,(H,68,69)/t57-,58-,59-,60-,61+,62+,63-,64+,65+,66-/m1/s1
InChIKey AXDSECXUBKMRRC-ZQYMCZFUSA-N
Mol Weight 1100.3 g/mol
Molecular Formula C67H73NO13
Exact Mass 1099.508191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2CSUlsX5sSg
Name 2-BENZYLOXYCARBONYLAMINOETHYL 2,4,6-TRI-O-BENZYL-3-O-(2-O-ALLYL-3,4,6-TRI-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-D-MANNOPYRANOSIDE
Comments 90
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C67H73NO13
InChI InChI=1S/C67H73NO13/c1-2-39-72-63-61(76-45-54-32-18-7-19-33-54)59(74-43-52-28-14-5-15-29-52)57(48-70-41-50-24-10-3-11-25-50)80-66(63)81-62-60(75-44-53-30-16-6-17-31-53)58(49-71-42-51-26-12-4-13-27-51)79-65(64(62)77-46-55-34-20-8-21-35-55)73-40-38-68-67(69)78-47-56-36-22-9-23-37-56/h2-37,57-66H,1,38-49H2,(H,68,69)/t57-,58-,59-,60-,61+,62+,63-,64+,65+,66-/m1/s1
InChIKey AXDSECXUBKMRRC-ZQYMCZFUSA-N
Instrument Name Bruker WM-250
Literature Reference A.YA.CHERNYAK, I.V.DEMIDOV, N.K.KOCHETKOV (1990) Bioorganich.Khim.(Russ.Lang.): v.16, N4, 537-549.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported