![C-[AOC-ALA-TRP-VAL]](/api/spectrum/tnr4TC3xQK/structure.png?h=300&w=458 "C-[AOC-ALA-TRP-VAL]")
| SpectraBase Compound ID | LnFB4wMZSU0 |
|---|---|
| InChI | InChI=1S/C27H39N5O4/c1-17(2)24-27(36)28-14-10-6-4-5-7-13-23(33)30-18(3)25(34)31-22(26(35)32-24)15-19-16-29-21-12-9-8-11-20(19)21/h8-9,11-12,16-18,22,24,29H,4-7,10,13-15H2,1-3H3,(H,28,36)(H,30,33)(H,31,34)(H,32,35)/t18-,22+,24-/m0/s1 |
| InChIKey | BUTRSVPFJPSMEI-ANJVHQHFSA-N |
| Mol Weight | 497.6 g/mol |
| Molecular Formula | C27H39N5O4 |
| Exact Mass | 497.300205 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | tnr4TC3xQK |
|---|---|
| Name | C-[AOC-ALA-TRP-VAL] |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H39N5O4 |
| InChI | InChI=1S/C27H39N5O4/c1-17(2)24-27(36)28-14-10-6-4-5-7-13-23(33)30-18(3)25(34)31-22(26(35)32-24)15-19-16-29-21-12-9-8-11-20(19)21/h8-9,11-12,16-18,22,24,29H,4-7,10,13-15H2,1-3H3,(H,28,36)(H,30,33)(H,31,34)(H,32,35)/t18-,22+,24-/m0/s1 |
| InChIKey | BUTRSVPFJPSMEI-ANJVHQHFSA-N |
| Literature Reference Author | S.TERRACCIANO,I.BRUNO,G.BIFULCO,J.E.COPPER,C.D.SMITH,L.GOMEZ -PALOMA,R.RICCIO |
| Literature Reference Citation | J.NAT.PROD.,67,1325(2004) |
| Literature Reference DOI | 10.1021/np049955b |
| Molecular Weight | 497.638 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ7338 |