M_3;11,11-DIHYDROXY-N-21-SULFOCARBAMOYL-SAXITOXIN
Compound with spectra: 1 NMR
| SpectraBase Compound ID | EPYkxFcCu3d |
|---|---|
| InChI | InChI=1S/C10H17N7O9S/c11-5-14-4-3(1-26-7(18)16-27(23,24)25)13-6(12)17-2-8(19,20)10(21,22)9(4,17)15-5/h3-4,19-22H,1-2H2,(H2,12,13)(H,16,18)(H3,11,14,15)(H,23,24,25)/p+1/t3-,4-,9-/m0/s1 |
| InChIKey | GEQVLVSQKTUBFK-GWWBTZNMSA-O |
| Mol Weight | 412.35 g/mol |
| Molecular Formula | C10H18N7O9S |
| Exact Mass | 412.088671 g/mol |
| Enantiomer InChIKey | GEQVLVSQKTUBFK-DASPXTJNSA-O |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | 60%_BENZENE-D6/CDCl3 |
| Title | Journal or Book | Year |
|---|---|---|
| Isolation and Structure Elucidation of New and Unusual Saxitoxin Analogues from Mussels | Journal of Natural Products | 2008 |
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.