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11-(6-O-TRANS-SINAPOYLGLUCOPYRANOSYL)-GARDENDIOL

View entire compound with spectra: 2 NMR

11-(6-O-TRANS-SINAPOYLGLUCOPYRANOSYL)-GARDENDIOL
SpectraBase Compound ID CJY8rDfiuw4
InChI InChI=1S/C27H34O13/c1-35-18-7-13(8-19(36-2)22(18)30)3-6-21(29)37-12-20-23(31)24(32)25(33)27(40-20)39-11-17-15-5-4-14(9-28)16(15)10-38-26(17)34/h3-4,6-8,15-17,20,23-25,27-28,30-33H,5,9-12H2,1-2H3/b6-3+/t15-,16+,17+,20-,23-,24+,25-,27-/m0/s1
InChIKey MRSXXJYRGDMBIT-VGQNNJSESA-N
Mol Weight 566.6 g/mol
Molecular Formula C27H34O13
Exact Mass 566.199941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4BpECdq4vZs
Name 11-(6-O-TRANS-SINAPOYLGLUCOPYRANOSYL)-GARDENDIOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H34O13
InChI InChI=1S/C27H34O13/c1-35-18-7-13(8-19(36-2)22(18)30)3-6-21(29)37-12-20-23(31)24(32)25(33)27(40-20)39-11-17-15-5-4-14(9-28)16(15)10-38-26(17)34/h3-4,6-8,15-17,20,23-25,27-28,30-33H,5,9-12H2,1-2H3/b6-3+/t15-,16+,17+,20-,23-,24+,25-,27-/m0/s1
InChIKey MRSXXJYRGDMBIT-VGQNNJSESA-N
Literature Reference Author Y.YU,Z.L.XIE,H.GAO,W.W.MA,Y.DAI,Y.WANG,Y.ZHONG,X.S.YAO
Literature Reference Citation J.NAT.PROD.,72,1459(2009)
Literature Reference DOI 10.1021/np900176q
Molecular Weight 566.559 g/mol
Sample ID 33363
Solvent CD3OD