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CUCURBITOSIDE_K;4-(HYDROXYMETHYL)-PHENYL_5-O-(2-S-2-METHYLBUTYRYL)-BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID AmU2ylPpWi5
InChI InChI=1S/C23H34O12/c1-3-12(2)20(29)31-10-23(30)11-32-22(19(23)28)35-18-17(27)16(26)15(9-25)34-21(18)33-14-6-4-13(8-24)5-7-14/h4-7,12,15-19,21-22,24-28,30H,3,8-11H2,1-2H3/t12-,15-,16-,17+,18-,19+,21-,22+,23-/m1/s1
InChIKey PWDKTMDATTYHBL-SADLMEJNSA-N
Mol Weight 502.5 g/mol
Molecular Formula C23H34O12
Exact Mass 502.205027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID El2oY0NkiDe
Name CUCURBITOSIDE_K;4-(HYDROXYMETHYL)-PHENYL_5-O-(2-S-2-METHYLBUTYRYL)-BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H34O12
InChI InChI=1S/C23H34O12/c1-3-12(2)20(29)31-10-23(30)11-32-22(19(23)28)35-18-17(27)16(26)15(9-25)34-21(18)33-14-6-4-13(8-24)5-7-14/h4-7,12,15-19,21-22,24-28,30H,3,8-11H2,1-2H3/t12-,15-,16-,17+,18-,19+,21-,22+,23-/m1/s1
InChIKey PWDKTMDATTYHBL-SADLMEJNSA-N
Literature Reference Author W.LI,K.KOIKE,M.TATSUZAKI,A.KOIDE,T.NIKAIDO
Literature Reference Citation J.NAT.PROD.,68,1754(2005)
Literature Reference DOI 10.1021/np050328b
Molecular Weight 502.516 g/mol
Solvent CD3OD
Source File Reference UWMZ12308