BrUCEANIC-A-METHYLESTER
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 4pXpUqwwozS |
|---|---|
| InChI | InChI=1S/C28H38O12/c1-12(2)13(3)8-17(30)40-20-22-27-11-38-28(22,25(35)37-7)23(33)19(32)21(27)26(5,10-18(31)36-6)15(14(4)29)9-16(27)39-24(20)34/h8,12,15-16,19-23,32-33H,9-11H2,1-7H3/b13-8+/t15-,16+,19+,20+,21+,22+,23-,26-,27+,28-/m0/s1 |
| InChIKey | YGHOWFTZPVOCHA-OACHQGFMSA-N |
| Mol Weight | 566.6 g/mol |
| Molecular Formula | C28H38O12 |
| Exact Mass | 566.236327 g/mol |
| Enantiomer InChIKey | YGHOWFTZPVOCHA-DIEKGJRESA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | PYRIDINE-D5 |
| Title | Journal or Book | Year |
|---|---|---|
| Antitumor Agents, 118. The Isolation and Characterization of Bruceanic Acid A, its Methyl Ester, and the New Bruceanic Acids B, C, and D, from Brucea antidysenterica | Journal of Natural Products | 1990 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.