| SpectraBase Compound ID | CYhzBgyXZZJ |
|---|---|
| InChI | InChI=1S/2C23H34N8O6S.2C2HF3O2/c2*1-31(2)18-9-3-7-15-14(18)6-4-10-19(15)38(36,37)28-12-20(33)29-17(13-32)22(35)30-16(21(24)34)8-5-11-27-23(25)26;2*3-2(4,5)1(6)7/h2*3-4,6-7,9-10,16-17,28,32H,5,8,11-13H2,1-2H3,(H2,24,34)(H,29,33)(H,30,35)(H4,25,26,27);2*(H,6,7) |
| InChIKey | PGJMUPGNWAVCJY-UHFFFAOYSA-N |
| Mol Weight | 1329.3 g/mol |
| Molecular Formula | C50H70F6N16O16S2 |
| Exact Mass | 1328.450132 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I70kV0tdSsA |
|---|---|
| Name | DANSYL-GLYCYL-SERYL-ARGINYL-NH2 |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H70F6N16O16S2 |
| InChI | InChI=1S/2C23H34N8O6S.2C2HF3O2/c2*1-31(2)18-9-3-7-15-14(18)6-4-10-19(15)38(36,37)28-12-20(33)29-17(13-32)22(35)30-16(21(24)34)8-5-11-27-23(25)26;2*3-2(4,5)1(6)7/h2*3-4,6-7,9-10,16-17,28,32H,5,8,11-13H2,1-2H3,(H2,24,34)(H,29,33)(H,30,35)(H4,25,26,27);2*(H,6,7) |
| InChIKey | PGJMUPGNWAVCJY-UHFFFAOYSA-N |
| Literature Reference Author | L.PROKAI,K.PROKAI-TATRAI,A.ZHARIKOVA,X.LI,J.R.ROCCA |
| Literature Reference Citation | J.MED.CHEM.,44,1623(2001) |
| Literature Reference DOI | 10.1021/jm000512o |
| Molecular Weight | 1329.314 g/mol |
| Sample ID | 44512 |
| Solvent | H2O |