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PENSTEMINOSIDE
SpectraBase Compound ID 4yZnF7KFxbj
InChI InChI=1S/C33H34O13/c34-20-10-6-19(7-11-20)9-12-23(35)42-16-22-27(38)28(39)29(40)32(44-22)45-31-25-21(14-15-41-31)26(37)30-33(25,46-30)17-43-24(36)13-8-18-4-2-1-3-5-18/h1-15,21-22,25-32,34,37-40H,16-17H2/b12-9+,13-8+/t21-,22+,25-,26+,27+,28-,29+,30+,31+,32-,33-/m1/s1
InChIKey WJAQWJBCGGXVJZ-BVKMSEHXSA-N
Mol Weight 638.6 g/mol
Molecular Formula C33H34O13
Exact Mass 638.199941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID QbFKpcFdEZ
Name PENSTEMINOSIDE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H34O13
InChI InChI=1S/C33H34O13/c34-20-10-6-19(7-11-20)9-12-23(35)42-16-22-27(38)28(39)29(40)32(44-22)45-31-25-21(14-15-41-31)26(37)30-33(25,46-30)17-43-24(36)13-8-18-4-2-1-3-5-18/h1-15,21-22,25-32,34,37-40H,16-17H2/b12-9+,13-8+/t21-,22+,25-,26+,27+,28-,29+,30+,31+,32-,33-/m1/s1
InChIKey WJAQWJBCGGXVJZ-BVKMSEHXSA-N
Literature Reference Author B.DINDA,D.R.CHOWDHURY,B.C.MOHANTA
Literature Reference Citation CHEM.PHARM.BULL.,57,765(2009)
Literature Reference DOI 10.1248/cpb.57.765
Molecular Weight 638.625 g/mol
Sample ID 2627
Solvent ACETONE-D6