![9.alpha.-(Acetoxy)-8.beta.-[(2'-methylbutanoyl)oxy]-14-hydroxy-acanthospermolide](/api/spectrum/3NVE8B9qkLG/structure.png?h=300&w=458 "9.alpha.-(Acetoxy)-8.beta.-[(2'-methylbutanoyl)oxy]-14-hydroxy-acanthospermolide")
| SpectraBase Compound ID | 5rKmo372vh4 |
|---|---|
| InChI | InChI=1S/C22H30O7/c1-6-13(3)21(25)29-20-18-14(4)22(26)28-17(18)10-12(2)8-7-9-16(11-23)19(20)27-15(5)24/h9-10,13,17-20,23H,4,6-8,11H2,1-3,5H3/b12-10+,16-9-/t13?,17?,18?,19-,20-/m0/s1 |
| InChIKey | CIWBNFCTQXHDPI-LGNXOSOHSA-N |
| Mol Weight | 406.48 g/mol |
| Molecular Formula | C22H30O7 |
| Exact Mass | 406.199153 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3NVE8B9qkLG |
|---|---|
| Name | 9.alpha.-(Acetoxy)-8.beta.-[(2'-methylbutanoyl)oxy]-14-hydroxy-acanthospermolide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O7 |
| InChI | InChI=1S/C22H30O7/c1-6-13(3)21(25)29-20-18-14(4)22(26)28-17(18)10-12(2)8-7-9-16(11-23)19(20)27-15(5)24/h9-10,13,17-20,23H,4,6-8,11H2,1-3,5H3/b12-10+,16-9-/t13?,17?,18?,19-,20-/m0/s1 |
| InChIKey | CIWBNFCTQXHDPI-LGNXOSOHSA-N |
| Molecular Weight | 406.475 g/mol |
| SMILES | OC\C=1[C@@]([C@](C2C(C(=O)OC2\C=C\(CCC/1)C)=C)(OC(=O)C(CC)C)[H])(OC(=O)C)[H] |
| SPLASH | splash10-0a4l-9001000000-6102380adde49e6cd890 |
| Source of Spectrum | G4-63-1328-26 |
| Wiley ID | 1608603 |