| SpectraBase Compound ID | 8v5ram7wC9P |
|---|---|
| InChI | InChI=1S/C30H52N12O2/c1-20-11-13-30(4,12-9-10-21(2)24(43)41-28(35)39-16-7-5-14-37-26(31)32)23(18-20)19-22(3)25(44)42-29(36)40-17-8-6-15-38-27(33)34/h9-10,12,18-19,23H,5-8,11,13-17H2,1-4H3,(H4,31,32,37)(H4,33,34,38)(H3,35,39,41,43)(H3,36,40,42,44)/b12-9+,21-10+,22-19+/t23-,30-/m0/s1 |
| InChIKey | GJLJUAOHBZWEOI-YTUCPFNOSA-N |
| Mol Weight | 612.8 g/mol |
| Molecular Formula | C30H52N12O2 |
| Exact Mass | 612.433619 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FAZicVi9KB6 |
|---|---|
| Name | BISTELLETTADINE-A |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52N12O2 |
| InChI | InChI=1S/C30H52N12O2/c1-20-11-13-30(4,12-9-10-21(2)24(43)41-28(35)39-16-7-5-14-37-26(31)32)23(18-20)19-22(3)25(44)42-29(36)40-17-8-6-15-38-27(33)34/h9-10,12,18-19,23H,5-8,11,13-17H2,1-4H3,(H4,31,32,37)(H4,33,34,38)(H3,35,39,41,43)(H3,36,40,42,44)/b12-9+,21-10+,22-19+/t23-,30-/m0/s1 |
| InChIKey | GJLJUAOHBZWEOI-YTUCPFNOSA-N |
| Literature Reference Author | S.TSUKAMOTO,T.YAMASHITA,S.MATSUNAGA,N.FUSETANI |
| Literature Reference Citation | J.ORG.CHEM.,64,3794(1999) |
| Literature Reference DOI | 10.1021/jo9903252 |
| Molecular Weight | 612.822 g/mol |
| Sample ID | 46055 |
| Solvent | DMSO-D6 |