| SpectraBase Compound ID | KbDw9i0neBd |
|---|---|
| InChI | InChI=1S/C30H34N2O8/c1-4-25(40-29(36)39-17-20-10-6-5-7-11-20)21(22(18-37-2)27(34)38-3)16-26-30(14-15-32(26)19-33)23-12-8-9-13-24(23)31-28(30)35/h5-13,18-19,21,25-26H,4,14-17H2,1-3H3,(H,31,35)/b22-18+/t21-,25+,26-,30+/m1/s1 |
| InChIKey | RDJDNVWFRKBTCA-YRWLHIDKSA-N |
| Mol Weight | 550.6 g/mol |
| Molecular Formula | C30H34N2O8 |
| Exact Mass | 550.231516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9NW8MoP4q6h |
|---|---|
| Name | RDJDNVWFRKBTCA-YRWLHIDKSA-N |
| Compound Number | 21A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H34N2O8 |
| InChI | InChI=1S/C30H34N2O8/c1-4-25(40-29(36)39-17-20-10-6-5-7-11-20)21(22(18-37-2)27(34)38-3)16-26-30(14-15-32(26)19-33)23-12-8-9-13-24(23)31-28(30)35/h5-13,18-19,21,25-26H,4,14-17H2,1-3H3,(H,31,35)/b22-18+/t21-,25+,26-,30+/m1/s1 |
| InChIKey | RDJDNVWFRKBTCA-YRWLHIDKSA-N |
| Literature Reference Author | H.TAKAYAMA,R.FUJIWARA,Y.KASAI,M.KITAJIMA,N.AIMI |
| Literature Reference Citation | ORG.LETTERS,5,2967(2003) |
| Literature Reference DOI | 10.1021/ol035128a |
| Molecular Weight | 550.609 g/mol |
| Sample ID | 47347 |
| Solvent | CDCl3 |