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O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->1')-(2S,3S,4E)-2-[N-(HEXADECANOYL)-AMIN
SpectraBase Compound ID 8Cvj99Vphaj
InChI InChI=1S/C65H109NO21/c1-13-15-17-19-21-23-25-27-29-31-33-35-37-39-52(86-64(75)65(10,11)12)51(66-55(74)40-38-36-34-32-30-28-26-24-22-20-18-16-14-2)41-78-62-60(82-49(8)72)59(81-48(7)71)57(54(84-62)43-77-45(4)68)87-63-61(83-50(9)73)58(80-47(6)70)56(79-46(5)69)53(85-63)42-76-44(3)67/h37,39,51-54,56-63H,13-36,38,40-43H2,1-12H3,(H,66,74)/b39-37+/t51-,52+,53-,54+,56+,57+,58+,59-,60+,61-,62+,63+/m0/s1
InChIKey ZIWJXNVTDDBVKO-CHKZMHDUSA-N
Mol Weight 1240.6 g/mol
Molecular Formula C65H109NO21
Exact Mass 1239.74921 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ipDEJMCzA
Name O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->1')-(2S,3S,4E)-2-[N-(HEXADECANOYL)-AMIN
Compound Number 6A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C65H109NO21
InChI InChI=1S/C65H109NO21/c1-13-15-17-19-21-23-25-27-29-31-33-35-37-39-52(86-64(75)65(10,11)12)51(66-55(74)40-38-36-34-32-30-28-26-24-22-20-18-16-14-2)41-78-62-60(82-49(8)72)59(81-48(7)71)57(54(84-62)43-77-45(4)68)87-63-61(83-50(9)73)58(80-47(6)70)56(79-46(5)69)53(85-63)42-76-44(3)67/h37,39,51-54,56-63H,13-36,38,40-43H2,1-12H3,(H,66,74)/b39-37+/t51-,52+,53-,54+,56+,57+,58+,59-,60+,61-,62+,63+/m0/s1
InChIKey ZIWJXNVTDDBVKO-CHKZMHDUSA-N
Literature Reference Author M.A.PETERSON,R.POLT
Literature Reference Citation J.ORG.CHEM.,58,4309(1993)
Literature Reference DOI 10.1021/jo00068a028
Molecular Weight 1240.575 g/mol
Solvent Unknown
Source File Reference UWSP814