| SpectraBase Compound ID | 6IG76AHKNdu |
|---|---|
| InChI | InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17-,18+,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1 |
| InChIKey | GMBQZIIUCVWOCD-WWASVFFGSA-N |
| Mol Weight | 416.6 g/mol |
| Molecular Formula | C27H44O3 |
| Exact Mass | 416.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JJOHmkhJ3Ny |
|---|---|
| Name | SMILAGENIN |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O3 |
| InChI | InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17-,18+,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1 |
| InChIKey | GMBQZIIUCVWOCD-WWASVFFGSA-N |
| Literature Reference Author | S.SEO,Y.TOMITA,K.TORI,Y.YOSHIMURA |
| Literature Reference Citation | J.AM.CHEM.SOC.,100,3331(1978) |
| Literature Reference DOI | 10.1021/ja00479a014 |
| Molecular Weight | 416.645 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS10416 |