| SpectraBase Compound ID | KQ6iNzpgQKK |
|---|---|
| InChI | InChI=1S/C30H48O6/c1-16-10-11-30(24(34)35)13-12-27(5)17(22(30)29(16,7)36)8-9-19-26(4)15-18(31)23(33)25(2,3)20(26)14-21(32)28(19,27)6/h8,16,18-23,31-33,36H,9-15H2,1-7H3,(H,34,35)/t16-,18?,19-,20?,21+,22+,23?,26?,27+,28-,29-,30-/m1/s1 |
| InChIKey | OTMKLLGULDKXFS-DJHLVVINSA-N |
| Mol Weight | 504.7 g/mol |
| Molecular Formula | C30H48O6 |
| Exact Mass | 504.345089 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | YPKuG14lh0 |
|---|---|
| Name | 7.alpha.-Hydroxy-tormentic-acid |
| Comments | APT, DEPT, INE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H48O6 |
| InChI | InChI=1S/C30H48O6/c1-16-10-11-30(24(34)35)13-12-27(5)17(22(30)29(16,7)36)8-9-19-26(4)15-18(31)23(33)25(2,3)20(26)14-21(32)28(19,27)6/h8,16,18-23,31-33,36H,9-15H2,1-7H3,(H,34,35)/t16-,18?,19-,20?,21+,22+,23?,26?,27+,28-,29-,30-/m1/s1 |
| InChIKey | OTMKLLGULDKXFS-DJHLVVINSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Phytochem. 25, 1939 (1986). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |