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METHYL-O-(2,3,4-TRI-O-BENZOYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->3)-(2,4-DI-O-BENZOYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-3-O-BENZOYL-4,6-O-BENZYLIDENE-ALPHA-D-GA
SpectraBase Compound ID H17Iu5HLYv1
InChI InChI=1S/C68H62O20/c1-40-50(80-59(69)42-25-11-4-12-26-42)53(82-61(71)44-29-15-6-16-30-44)57(84-63(73)46-33-19-8-20-34-46)67(77-40)87-54-51(81-60(70)43-27-13-5-14-28-43)41(2)78-68(58(54)85-64(74)47-35-21-9-22-36-47)88-56-55(83-62(72)45-31-17-7-18-32-45)52-49(79-66(56)75-3)39-76-65(86-52)48-37-23-10-24-38-48/h4-38,40-41,49-58,65-68H,39H2,1-3H3/t40-,41-,49-,50-,51-,52+,53+,54+,55+,56-,57+,58+,65?,66+,67-,68-/m1/s1
InChIKey GEGTXSMACHGJNW-GKUQPTSZSA-N
Mol Weight 1199.2 g/mol
Molecular Formula C68H62O20
Exact Mass 1198.383444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KfZtIfJFtsx
Name METHYL-O-(2,3,4-TRI-O-BENZOYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->3)-(2,4-DI-O-BENZOYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-3-O-BENZOYL-4,6-O-BENZYLIDENE-ALPHA-D-GA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C68H62O20
InChI InChI=1S/C68H62O20/c1-40-50(80-59(69)42-25-11-4-12-26-42)53(82-61(71)44-29-15-6-16-30-44)57(84-63(73)46-33-19-8-20-34-46)67(77-40)87-54-51(81-60(70)43-27-13-5-14-28-43)41(2)78-68(58(54)85-64(74)47-35-21-9-22-36-47)88-56-55(83-62(72)45-31-17-7-18-32-45)52-49(79-66(56)75-3)39-76-65(86-52)48-37-23-10-24-38-48/h4-38,40-41,49-58,65-68H,39H2,1-3H3/t40-,41-,49-,50-,51-,52+,53+,54+,55+,56-,57+,58+,65?,66+,67-,68-/m1/s1
InChIKey GEGTXSMACHGJNW-GKUQPTSZSA-N
Literature Reference Author P.KOVAC,K.J.EDGAR
Literature Reference Citation J.ORG.CHEM.,57,2455(1992)
Literature Reference DOI 10.1021/jo00034a047
Molecular Weight 1199.228 g/mol
Solvent CDCl3
Source File Reference UWCS4081