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BACOPASIDE-C;[5-O-P-HYDROXYBENZOYL-BETA-D-APIOFURANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID Hnth7cMvc6n
InChI InChI=1S/C26H32O12/c27-12-18-19(29)20(30)21(24(37-18)34-11-10-15-4-2-1-3-5-15)38-25-22(31)26(33,14-36-25)13-35-23(32)16-6-8-17(28)9-7-16/h1-9,18-22,24-25,27-31,33H,10-14H2/t18-,19-,20+,21-,22+,24-,25+,26-/m1/s1
InChIKey PBRJTYBOSTVXGS-JUKYQPCLSA-N
Mol Weight 536.5 g/mol
Molecular Formula C26H32O12
Exact Mass 536.189376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID y9MypsCS0z
Name BACOPASIDE-C;[5-O-P-HYDROXYBENZOYL-BETA-D-APIOFURANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32O12
InChI InChI=1S/C26H32O12/c27-12-18-19(29)20(30)21(24(37-18)34-11-10-15-4-2-1-3-5-15)38-25-22(31)26(33,14-36-25)13-35-23(32)16-6-8-17(28)9-7-16/h1-9,18-22,24-25,27-31,33H,10-14H2/t18-,19-,20+,21-,22+,24-,25+,26-/m1/s1
InChIKey PBRJTYBOSTVXGS-JUKYQPCLSA-N
Literature Reference Author C.C.HOU,S.J.LIN,J.T.CHENG,F.L.HSU
Literature Reference Citation J.NAT.PROD.,65,1759(2002)
Literature Reference DOI 10.1021/np020238w
Molecular Weight 536.533 g/mol
Solvent ACETONE-D6:D2O
Source File Reference UWSI16387