| 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
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| SpectraBase Spectrum ID | QbFKpcFdEZ |
|---|---|
| Name | PENSTEMINOSIDE |
| Compound Number | 27 |
| Copyright | Copyright © 2016-2025 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 |