| SpectraBase Compound ID | HY0PuJUpxkv |
|---|---|
| InChI | InChI=1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3/t18-,20?,21?,22?,23-,24?,25?,26?,27+,28?,29?,31?,32?,33+,34+,35+,36-/m1/s1 |
| InChIKey | WKKBYJLXSKPKSC-UIALQZDUSA-N |
| Mol Weight | 666.8 g/mol |
| Molecular Formula | C36H58O11 |
| Exact Mass | 666.397913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBH10pcbLej |
|---|---|
| Name | Niga-ichigoside-F1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H58O11 |
| InChI | InChI=1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3/t18-,20?,21?,22?,23-,24?,25?,26?,27+,28?,29?,31?,32?,33+,34+,35+,36-/m1/s1 |
| InChIKey | WKKBYJLXSKPKSC-UIALQZDUSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | Phytochem. 23, 2829 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine |