| SpectraBase Compound ID | LGD13nijtJI |
|---|---|
| InChI | InChI=1S/C33H52O4/c1-21(34)37-26-13-14-31(7)24(29(26,4)5)12-15-32(8)25(31)11-10-22-23-20-28(2,3)16-17-30(23,6)18-19-33(22,32)27(35)36-9/h10,23-26H,11-20H2,1-9H3/t23-,24?,25+,26?,30-,31?,32+,33-/m1/s1 |
| InChIKey | BTXMQLPBVDWIIU-UDWHBNLSSA-N |
| Mol Weight | 512.8 g/mol |
| Molecular Formula | C33H52O4 |
| Exact Mass | 512.38656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1pp7Af9qpkI |
|---|---|
| Name | Methyl-3.alpha.-acetoxyolean-12-en-27-oate |
| CAS Registry Number | 86783-77-9 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C33H52O4 |
| InChI | InChI=1S/C33H52O4/c1-21(34)37-26-13-14-31(7)24(29(26,4)5)12-15-32(8)25(31)11-10-22-23-20-28(2,3)16-17-30(23,6)18-19-33(22,32)27(35)36-9/h10,23-26H,11-20H2,1-9H3/t23-,24?,25+,26?,30-,31?,32+,33-/m1/s1 |
| InChIKey | BTXMQLPBVDWIIU-UDWHBNLSSA-N |
| Literature Reference | J. Org. Chem. 48, 3525 (1983). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |