| SpectraBase Compound ID | 6jAv78l7Mqa |
|---|---|
| InChI | InChI=1S/C25H33N5O11S/c1-10-16(32)6-17(33)11-8-42-9-14(21(27)36)29-22(37)13(7-41-25(40)19(10)11)28-23(38)20-15(31)4-5-30(20)24(39)12(26)2-3-18(34)35/h6,12-15,20,31-33H,2-5,7-9,26H2,1H3,(H2,27,36)(H,28,38)(H,29,37)(H,34,35)/t12-,13-,14-,15+,20-/m0/s1 |
| InChIKey | PVRMXRCYXJPYJV-MOMPZSSISA-N |
| Mol Weight | 611.6 g/mol |
| Molecular Formula | C25H33N5O11S |
| Exact Mass | 611.189728 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 | 5tF00r3S8JN |
|---|---|
| Name | CYClOTHIALIDINE-E |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H33N5O11S |
| InChI | InChI=1S/C25H33N5O11S/c1-10-16(32)6-17(33)11-8-42-9-14(21(27)36)29-22(37)13(7-41-25(40)19(10)11)28-23(38)20-15(31)4-5-30(20)24(39)12(26)2-3-18(34)35/h6,12-15,20,31-33H,2-5,7-9,26H2,1H3,(H2,27,36)(H,28,38)(H,29,37)(H,34,35)/t12-,13-,14-,15+,20-/m0/s1 |
| InChIKey | PVRMXRCYXJPYJV-MOMPZSSISA-N |
| Literature Reference Author | K.YAMAJI,M.MASUBUCHI,F.KAWAHARA,Y.NAKAMURA,A.NISHIO,S.MATSUK UMA,M.FUJIMORI,N.NAK |
| Literature Reference Citation | J.ANTIBIOTICS,50,402(1997) |
| Literature Reference DOI | 10.7164/antibiotics.50.402 |
| Molecular Weight | 611.624 g/mol |
| Solvent | D2O |
| Source File Reference | UWGE2946 |