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PULVERULENTOSIDE-I;6-O-(3''-O-ACETYL-2''-O-TRANS-PARA-METHOXYCINNAMOYL)-ALPHA-L-RHAMNOPYRANOSYL-CATALPOL
SpectraBase Compound ID GfZBTryB0qi
InChI InChI=1S/C33H42O17/c1-14-22(38)27(45-15(2)36)28(47-20(37)9-6-16-4-7-17(42-3)8-5-16)32(44-14)48-26-18-10-11-43-30(21(18)33(13-35)29(26)50-33)49-31-25(41)24(40)23(39)19(12-34)46-31/h4-11,14,18-19,21-32,34-35,38-41H,12-13H2,1-3H3/b9-6+/t14-,18-,19+,21-,22-,23+,24-,25+,26+,27+,28+,29+,30+,31-,32-,33-/m1/s1
InChIKey AUVKOEQGZIDTGI-JMOQDFQKSA-N
Mol Weight 710.7 g/mol
Molecular Formula C33H42O17
Exact Mass 710.2422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtnxcetbGZf
Name PULVERULENTOSIDE-I;6-O-(3''-O-ACETYL-2''-O-TRANS-PARA-METHOXYCINNAMOYL)-ALPHA-L-RHAMNOPYRANOSYL-CATALPOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H42O17
InChI InChI=1S/C33H42O17/c1-14-22(38)27(45-15(2)36)28(47-20(37)9-6-16-4-7-17(42-3)8-5-16)32(44-14)48-26-18-10-11-43-30(21(18)33(13-35)29(26)50-33)49-31-25(41)24(40)23(39)19(12-34)46-31/h4-11,14,18-19,21-32,34-35,38-41H,12-13H2,1-3H3/b9-6+/t14-,18-,19+,21-,22-,23+,24-,25+,26+,27+,28+,29+,30+,31-,32-,33-/m1/s1
InChIKey AUVKOEQGZIDTGI-JMOQDFQKSA-N
Literature Reference Author Z.S.AKDEMIR,I.I.TATLI,E.BEDIR,I.A.KHAN
Literature Reference Citation TURK.J.CHEM.,28,101(2004)
Molecular Weight 710.686 g/mol
Solvent DMSO-D6
Source File Reference UWLU5900