| SpectraBase Compound ID | LsFvh28GbQV |
|---|---|
| InChI | InChI=1S/C22H38O5/c1-16-5-8-20-21(3,10-4-11-22(20,14-24)15-25)19(16)7-6-18(13-23)9-12-27-17(2)26/h8,16,18-19,23-25H,4-7,9-15H2,1-3H3/t16-,18?,19?,21+/m0/s1 |
| InChIKey | LJMWAXIAAXBUJR-XDTATTDVSA-N |
| Mol Weight | 382.5 g/mol |
| Molecular Formula | C22H38O5 |
| Exact Mass | 382.271924 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1iuhTqsbVw |
|---|---|
| Name | Gaudichaudol B |
| Alternate Name(s) | Gaudichaudol A-Acetate Acetic acid [5-[(2S,8aR)-5,5-bis(hydroxymethyl)-2,8a-dimethyl-1,2,3,6,7,8-hexahydronaphthalen-1-yl]-3-(hydroxymethyl)pentyl] ester [5-[(2S,8aR)-5,5-bis(hydroxymethyl)-2,8a-dimethyl-1,2,3,6,7,8-hexahydronaphthalen-1-yl]-3-(hydroxymethyl)pentyl] acetate [5-[(2S,8aR)-5,5-bis(hydroxymethyl)-2,8a-dimethyl-1,2,3,6,7,8-hexahydronaphthalen-1-yl]-3-(hydroxymethyl)pentyl] ethanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H38O5 |
| InChI | InChI=1S/C22H38O5/c1-16-5-8-20-21(3,10-4-11-22(20,14-24)15-25)19(16)7-6-18(13-23)9-12-27-17(2)26/h8,16,18-19,23-25H,4-7,9-15H2,1-3H3/t16-,18?,19?,21+/m0/s1 |
| InChIKey | LJMWAXIAAXBUJR-XDTATTDVSA-N |
| Molecular Weight | 382.541 g/mol |
| SMILES | OCC(CCC1[C@@]2(C(C(CO)(CCC2)CO)=CC[C@@]1(C)[H])C)CCOC(=O)C |
| SPLASH | splash10-054k-1910000000-7851b8911f96d9f772fb |
| Source of Spectrum | X2-57-806-2 |
| Wiley ID | 1605460 |