THEONELLAMIDE-C
Compound with spectra: 1 NMR
| SpectraBase Compound ID | CCR7PFZcSal |
|---|---|
| InChI | InChI=1S/C69H87BrN16O22/c1-34(13-14-36-15-17-39(70)18-16-36)21-51(91)42-28-55(95)77-49(31-87)65(103)82-48-30-86-29-40(74-33-86)24-45(62(100)84-56(35(2)89)67(105)83-50(32-88)66(104)79-44(61(99)78-42)23-38-11-7-4-8-12-38)75-54(94)26-41(90)25-47(69(107)108)76-53(93)19-20-73-60(98)43(22-37-9-5-3-6-10-37)81-68(106)57(58(96)59(72)97)85-63(101)46(27-52(71)92)80-64(48)102/h3-18,21,29,33,35,41-51,56-58,87-91,96H,19-20,22-28,30-32H2,1-2H3,(H2,71,92)(H2,72,97)(H,73,98)(H,75,94)(H,76,93)(H,77,95)(H,78,99)(H,79,104)(H,80,102)(H,81,106)(H,82,103)(H,83,105)(H,84,100)(H,85,101)(H,107,108)/b14-13+,34-21+/t35-,41+,42-,43-,44-,45-,46-,47-,48+,49-,50-,51+,56-,57-,58+/m0/s1 |
| InChIKey | XWWMKHNRJFSZAC-NQQDHSHNSA-N |
| Mol Weight | 1572.4 g/mol |
| Molecular Formula | C69H87BrN16O22 |
| Exact Mass | 1570.536421 g/mol |
| Enantiomer InChIKey | XWWMKHNRJFSZAC-VSSJVQFHSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6:H2O=4:1 |
THEONELLAMIDE-F
DREGAMIN-3-ALPHA-OL
TABERNAEMONTANIN-3-BETA-OL
Dregaminol
3.beta.,21-Diacetoxy-5.alpha.,17.alpha.-preg-14-en-20-one
ICHTHYOPEPTIN_A
8-(GAMMA,GAMMA-DIMETHYL-ALLYL)-3,5-DIHYDROXY-6,6-DIMETHYL-PYRANYL-[6,7-A]-FLAVANONOL
MICROPEPTIN-EI992
ETHYL-LITHOSPERMATE
(5R)-1-aza-3(R)-phenyl-4(S)-(((tert-butyldimethylsilyl)oxy)methyl)-4(S)-carboxy-6(R)-hydroxybicyclo[3.3.0]octane lactone
| 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.