| SpectraBase Compound ID | Lh3WA5Sos2J |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-19-10-15-30(25(32)33-7)17-16-28(5)20(21(30)18-19)8-9-23-27(4)13-12-24(31)26(2,3)22(27)11-14-29(23,28)6/h8,21-24,31H,1,9-18H2,2-7H3/t21-,22?,23?,24?,27?,28+,29?,30-/m1/s1 |
| InChIKey | AZOLERDGPOJEIJ-CRGDFBEGSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2tGYnHASkZs |
|---|---|
| Name | Methyl-3.beta.-hydroxy-30-norolean-12,20(29)-dien-28-oate |
| CAS Registry Number | 104777-64-2 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-19-10-15-30(25(32)33-7)17-16-28(5)20(21(30)18-19)8-9-23-27(4)13-12-24(31)26(2,3)22(27)11-14-29(23,28)6/h8,21-24,31H,1,9-18H2,2-7H3/t21-,22?,23?,24?,27?,28+,29?,30-/m1/s1 |
| InChIKey | AZOLERDGPOJEIJ-CRGDFBEGSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Phytochem. 25, 1625 (1986). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |