| SpectraBase Compound ID | I7vbjx0i0JS |
|---|---|
| InChI | InChI=1S/C26H33N3O7/c1-3-19(2)24(26(35)36)29-23(32)17-15-13-11-9-7-5-4-6-8-10-12-14-16-22(31)28-20(25(33)34)18-21(27)30/h4-17,19-20,24H,3,18H2,1-2H3,(H2,27,30)(H,28,31)(H,29,32)(H,33,34)(H,35,36)/b5-4+,8-6+,9-7+,12-10+,13-11+,16-14+,17-15+/t19-,20-,24-/m0/s1 |
| InChIKey | WMLBQOCWBZNSJH-GHHGTSARSA-N |
| Mol Weight | 499.6 g/mol |
| Molecular Formula | C26H33N3O7 |
| Exact Mass | 499.23185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H2XSMeLSvX2 |
|---|---|
| Name | BOLETOCROCIN-B |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H33N3O7 |
| InChI | InChI=1S/C26H33N3O7/c1-3-19(2)24(26(35)36)29-23(32)17-15-13-11-9-7-5-4-6-8-10-12-14-16-22(31)28-20(25(33)34)18-21(27)30/h4-17,19-20,24H,3,18H2,1-2H3,(H2,27,30)(H,28,31)(H,29,32)(H,33,34)(H,35,36)/b5-4+,8-6+,9-7+,12-10+,13-11+,16-14+,17-15+/t19-,20-,24-/m0/s1 |
| InChIKey | WMLBQOCWBZNSJH-GHHGTSARSA-N |
| Literature Reference Author | L.KAHNER,J.DASENBROCK,P.SPITELLER,W.STEGLICH,R.MARUMOTO,M.SP ITELLER |
| Literature Reference Citation | PHYTOCHEM.,49,1693(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00319-7 |
| Molecular Weight | 499.564 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU646 |