SCELERITODERMIN-A
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 18cbW7WKgRN |
|---|---|
| InChI | InChI=1S/C42H55N7O13S2.Na/c1-6-24(3)34-35(51)38(54)44-29(19-26-11-13-28(50)14-12-26)39-43-27(22-63-39)18-23(2)17-25(4)42(57)62-21-30(40(55)48-15-8-10-33(48)37(53)46-34)45-36(52)32-9-7-16-49(32)41(56)31(20-61-5)47-64(58,59)60;/h11-14,17-18,22,24,29-34,47,50H,6-10,15-16,19-21H2,1-5H3,(H,44,54)(H,45,52)(H,46,53)(H,58,59,60);/q;+1/p-1/b23-18+,25-17-;/t24-,29+,30+,31+,32-,33+,34+;/m1./s1 |
| InChIKey | MJCWFUMOVWRXTI-AISDHTIISA-M |
| Mol Weight | 952.0 g/mol |
| Molecular Formula | C42H54N7NaO13S2 |
| Exact Mass | 951.311871 g/mol |
| Parent InChIKey | FBWRNVAZLCEZQO-TZUKGBQRSA-M |
| Enantiomer InChIKey | MJCWFUMOVWRXTI-MMEZQYODSA-M |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Title | Journal or Book | Year |
|---|---|---|
| Scleritodermin A, a Cytotoxic Cyclic Peptide from the Lithistid Sponge Scleritoderma nodosum | Journal of Natural Products | 2004 |
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.