| SpectraBase Compound ID | Bj0JWLfT6B3 |
|---|---|
| InChI | InChI=1S/C27H36N2O8/c1-26(2)34-21-19(33-25-23(22(21)35-26)36-27(3,4)37-25)11-8-12-20(30)29-18(24(31)32-5)13-15-14-28-17-10-7-6-9-16(15)17/h6-7,9-10,14,18-19,21-23,25,28H,8,11-13H2,1-5H3,(H,29,30)/t18-,19?,21-,22-,23+,25+/m0/s1 |
| InChIKey | NEWXYLDEBMRHBG-BJZDRENHSA-N |
| Mol Weight | 516.6 g/mol |
| Molecular Formula | C27H36N2O8 |
| Exact Mass | 516.247166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5eNXjLJ9IEp |
|---|---|
| Name | NEWXYLDEBMRHBG-BJZDRENHSA-N |
| Compound Number | 4I |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36N2O8 |
| InChI | InChI=1S/C27H36N2O8/c1-26(2)34-21-19(33-25-23(22(21)35-26)36-27(3,4)37-25)11-8-12-20(30)29-18(24(31)32-5)13-15-14-28-17-10-7-6-9-16(15)17/h6-7,9-10,14,18-19,21-23,25,28H,8,11-13H2,1-5H3,(H,29,30)/t18-,19?,21-,22-,23+,25+/m0/s1 |
| InChIKey | NEWXYLDEBMRHBG-BJZDRENHSA-N |
| Literature Reference Author | S.CADDICK,D.HAMZA,S.N.WADMAN,J.D.WILDEN |
| Literature Reference Citation | ORG.LETTERS,4,1775(2002) |
| Literature Reference DOI | 10.1021/ol025846h |
| Molecular Weight | 516.591 g/mol |
| Sample ID | 32972 |
| Solvent | CDCl3 |