| SpectraBase Compound ID | CshfMqUbyoM |
|---|---|
| InChI | InChI=1S/C26H40O5/c1-19(2)17-23(28)30-21-12-16-25(5,14-8-13-24(3,4)29-7)15-11-20(18-27)9-10-22-26(21,6)31-22/h8,11-13,16-17,21-22,27H,9-10,14-15,18H2,1-7H3/b13-8+,16-12+,20-11+/t21-,22+,25+,26+/m1/s1 |
| InChIKey | TVVRWBNLBVCRPH-XYBUGXQZSA-N |
| Mol Weight | 432.6 g/mol |
| Molecular Formula | C26H40O5 |
| Exact Mass | 432.287574 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CgNVBHn9Wk2 |
|---|---|
| Name | Vibsanin Q |
| Appearance | Colorless amorphous solid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H40O5 |
| InChI | InChI=1S/C26H40O5/c1-19(2)17-23(28)30-21-12-16-25(5,14-8-13-24(3,4)29-7)15-11-20(18-27)9-10-22-26(21,6)31-22/h8,11-13,16-17,21-22,27H,9-10,14-15,18H2,1-7H3/b13-8+,16-12+,20-11+/t21-,22+,25+,26+/m1/s1 |
| InChIKey | TVVRWBNLBVCRPH-XYBUGXQZSA-N |
| Instrument Name | JEOL JMS-SX/SX 102A |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np030447w |
| Molecular Weight | 432.601 g/mol |
| Optical Rotation | [a]D25 = +23 (c = 0.4, CHCl3) |
| Reported Formula | C26H40O5 |
| SMILES | OC\C=1CC[C@]2([C@]([C@@](\C=C\[C@@](CC/1)(C)C\C=C\C(C)(C)OC)(OC(C=C(C)C)=O)[H])(O2)C)[H] |
| SPLASH | splash10-001i-9600000000-cc6a742c730b8f80ec2d |
| Source of Spectrum | G4-67-336-2 |
| Wiley ID | 1881696 |