THEONELLAMIDE-B
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 79jq91TICNN |
|---|---|
| InChI | InChI=1S/C70H89BrN16O23/c1-33(14-15-36-10-6-4-7-11-36)20-50(92)42-26-54(96)77-48(30-88)64(103)82-47-29-87-28-40(75-32-87)22-44(61(100)85-56(35(3)90)68(107)83-49(31-89)65(104)79-43(60(99)78-42)21-37-12-8-5-9-13-37)76-53(95)24-41(91)23-46(70(109)110)81-66(105)51(93)27-74-67(106)55(34(2)38-16-18-39(71)19-17-38)84-69(108)57(58(97)59(73)98)86-62(101)45(25-52(72)94)80-63(47)102/h4-20,28,32,34-35,41-51,55-58,88-93,97H,21-27,29-31H2,1-3H3,(H2,72,94)(H2,73,98)(H,74,106)(H,76,95)(H,77,96)(H,78,99)(H,79,104)(H,80,102)(H,81,105)(H,82,103)(H,83,107)(H,84,108)(H,85,100)(H,86,101)(H,109,110)/b15-14+,33-20+/t34-,35-,41+,42-,43-,44-,45-,46-,47+,48-,49-,50-,51-,55-,56-,57-,58+/m0/s1 |
| InChIKey | KCSHJPKODMBFHJ-HRYJRHHDSA-N |
| Mol Weight | 1602.5 g/mol |
| Molecular Formula | C70H89BrN16O23 |
| Exact Mass | 1600.546986 g/mol |
| Enantiomer InChIKey | KCSHJPKODMBFHJ-FSBUCWKRSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6:H2O=4:1 |
CALLYNORMINE-A
3,3''-DIMETHYL-LITHOSPERMIC-ACID-B
10-{1-[(E)-Ethoxyimino]-ethyl}-3-phenyl-1H-[1,3,5]triazino[1,2-a]indole-2,4-dione
ISOSAPONARIN
GELOMULOSIDE B
3-(4-Chlorophenyl)-2-[(3-ethyl-5-formyl-4-methyl-1H-pyrrol-2-yl)methyl]-4,6-dimethoxy-1H-indole-7-carbaldehyde
N-ACETYLGITINGENSINE
13-(tert-Butyldimethylsiloxy)[121]tetramantan-6-ol
1-{2,2-Di-tert-butyl-5-[(2,2-di-tert-butyl-4-oxo-4H-1,3,2-dioxasilin-6-yl)methyl]naphtho[1,8-de][1,3,2]dioxasilin-4-yl}-3-hydroxyhex-2-ene-1,5-dione
Pyrrolo[3,4-c]pyrrole-1-carboxylic acid, octahydro-1-methyl-4,6-dioxo-3,5-diphenyl-, 2-propenyl ester, (1.alpha.,3.alpha.,3a.beta.,6a.beta.)-(.+-.)-
| Title | Journal or Book | Year |
|---|---|---|
| Theonellamides A-E, cytotoxic bicyclic peptides, from a marine sponge Theonella sp. | The Journal of Organic Chemistry | 1995 |
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.