| SpectraBase Compound ID | 2X3jcl8tnn8 |
|---|---|
| InChI | InChI=1S/C25H38O5/c1-18(2)16-22(27)29-20-11-15-24(5,13-7-12-23(3,4)28)14-10-19(17-26)8-9-21-25(20,6)30-21/h7,10-12,15-16,20-21,26,28H,8-9,13-14,17H2,1-6H3/b12-7+,15-11+,19-10+/t20-,21+,24+,25+/m1/s1 |
| InChIKey | ISSYTMWXBGIZDF-XWMBFTBISA-N |
| Mol Weight | 418.6 g/mol |
| Molecular Formula | C25H38O5 |
| Exact Mass | 418.271924 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4HkDMCfFvoG |
|---|---|
| Name | Vibsanin P |
| Appearance | Colorless amorphous solid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H38O5 |
| InChI | InChI=1S/C25H38O5/c1-18(2)16-22(27)29-20-11-15-24(5,13-7-12-23(3,4)28)14-10-19(17-26)8-9-21-25(20,6)30-21/h7,10-12,15-16,20-21,26,28H,8-9,13-14,17H2,1-6H3/b12-7+,15-11+,19-10+/t20-,21+,24+,25+/m1/s1 |
| InChIKey | ISSYTMWXBGIZDF-XWMBFTBISA-N |
| Instrument Name | JEOL JMS-SX/SX 102A |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np030447w |
| Molecular Weight | 418.574 g/mol |
| Optical Rotation | [a]D25 = +24 (c = 0.3, CHCl3) |
| Reported Formula | C25H38O5 |
| SMILES | OC\C=1CC[C@]2([C@]([C@@](\C=C\[C@@](C\C=C\C(C)(C)O)(CC/1)C)(OC(C=C(C)C)=O)[H])(O2)C)[H] |
| SPLASH | splash10-001i-9402000000-fa1b0695f4591bbb1ca4 |
| Source of Spectrum | G4-67-336-1 |
| Wiley ID | 1881695 |