| SpectraBase Compound ID | ETIRFrVeilm |
|---|---|
| InChI | InChI=1S/C36H52N8O6S2/c1-11-17(7)25-33-43-27(19(9)49-33)31(47)39-24(16(5)6)36-38-22(14-52-36)30(46)42-26(18(8)12-2)34-44-28(20(10)50-34)32(48)40-23(15(3)4)35-37-21(13-51-35)29(45)41-25/h13-20,23-28H,11-12H2,1-10H3,(H,39,47)(H,40,48)(H,41,45)(H,42,46) |
| InChIKey | QBRRPBPLIGDANJ-UHFFFAOYSA-N |
| Mol Weight | 757.0 g/mol |
| Molecular Formula | C36H52N8O6S2 |
| Exact Mass | 756.345124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DLy7GBtgEAq |
|---|---|
| Name | Ascidiacyclamide |
| CAS Registry Number | 86701-12-4 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H52N8O6S2 |
| InChI | InChI=1S/C36H52N8O6S2/c1-11-17(7)25-33-43-27(19(9)49-33)31(47)39-24(16(5)6)36-38-22(14-52-36)30(46)42-26(18(8)12-2)34-44-28(20(10)50-34)32(48)40-23(15(3)4)35-37-21(13-51-35)29(45)41-25/h13-20,23-28H,11-12H2,1-10H3,(H,39,47)(H,40,48)(H,41,45)(H,42,46) |
| InChIKey | QBRRPBPLIGDANJ-UHFFFAOYSA-N |
| Literature Reference | Y. Hamamoto, M. Endo, M. Nakagawa, J. Chem. Soc. Chem. Comm. 323 (1983). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |