| SpectraBase Compound ID | 6QWbYlNI2uQ |
|---|---|
| InChI | InChI=1S/C26H27NO7/c1-3-12-7-13-9-17(29)22-23(20(13)16(28)8-12)25(31)14-5-4-6-18(21(14)26(22)32)34-19-10-15(27)24(30)11(2)33-19/h4-6,9,11-12,15,19,24,29-30H,3,7-8,10,27H2,1-2H3/t11-,12-,15+,19-,24-/m0/s1 |
| InChIKey | GMELFDQPUZSJEE-XHBGPGOOSA-N |
| Mol Weight | 465.5 g/mol |
| Molecular Formula | C26H27NO7 |
| Exact Mass | 465.178752 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B8t14u8ANo3 |
|---|---|
| Name | BrASILIQUINONE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H27NO7 |
| InChI | InChI=1S/C26H27NO7/c1-3-12-7-13-9-17(29)22-23(20(13)16(28)8-12)25(31)14-5-4-6-18(21(14)26(22)32)34-19-10-15(27)24(30)11(2)33-19/h4-6,9,11-12,15,19,24,29-30H,3,7-8,10,27H2,1-2H3/t11-,12-,15+,19-,24-/m0/s1 |
| InChIKey | GMELFDQPUZSJEE-XHBGPGOOSA-N |
| Literature Reference Author | M.TSUDA,H.SATO,Y.TANAKA,K.YAZAWA,Y.MIKAMI,T.SASAKI,J.KOBAYAS HI |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1773(1996) |
| Literature Reference DOI | 10.1039/p19960001773 |
| Molecular Weight | 465.503 g/mol |
| Solvent | CDCl3 |
| Source File Reference | WANG2054 |