| SpectraBase Compound ID | 8OtMDTXwwRN |
|---|---|
| InChI | InChI=1S/C41H44O21/c1-18(42)53-26-11-9-25(10-12-26)29-15-28(49)34-30(60-29)13-27(50-8)14-31(34)61-41-39(59-24(7)48)37(57-22(5)46)35(55-20(3)44)33(62-41)17-52-40-38(58-23(6)47)36(56-21(4)45)32(16-51-40)54-19(2)43/h9-15,32-33,35-41H,16-17H2,1-8H3/t32-,33-,35-,36+,37+,38-,39-,40+,41-/m1/s1 |
| InChIKey | OSFFSVQQMOLGGN-UBYNLXJOSA-N |
| Mol Weight | 872.8 g/mol |
| Molecular Formula | C41H44O21 |
| Exact Mass | 872.237508 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BipxxwMv59u |
|---|---|
| Name | 5-O-B-D-Primeverosyl-genkwanine heptaacetate |
| CAS Registry Number | 77086-84-1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C41H44O21 |
| InChI | InChI=1S/C41H44O21/c1-18(42)53-26-11-9-25(10-12-26)29-15-28(49)34-30(60-29)13-27(50-8)14-31(34)61-41-39(59-24(7)48)37(57-22(5)46)35(55-20(3)44)33(62-41)17-52-40-38(58-23(6)47)36(56-21(4)45)32(16-51-40)54-19(2)43/h9-15,32-33,35-41H,16-17H2,1-8H3/t32-,33-,35-,36+,37+,38-,39-,40+,41-/m1/s1 |
| InChIKey | OSFFSVQQMOLGGN-UBYNLXJOSA-N |
| Instrument Name | Varian CFT-20 |
| Literature Reference | A. Garcia-Granados, J.M. Saenz, Org. Magn. Resonance 13, 462 (1980). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |