| SpectraBase Compound ID | 1CVUfiynECF |
|---|---|
| InChI | InChI=1S/C23H34O5/c1-5-16-6-8-18-17-7-9-20(25)23(14-28-15(2)24,13-11-21(26)27-4)19(17)10-12-22(16,18)3/h5,16-19H,1,6-14H2,2-4H3/t16-,17-,18-,19-,22+,23-/m0/s1 |
| InChIKey | UAGNMZDUATTXGU-HEVMPEIHSA-N |
| Mol Weight | 390.5 g/mol |
| Molecular Formula | C23H34O5 |
| Exact Mass | 390.240624 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LQqt5rzkQzt |
|---|---|
| Name | Muricenone A |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H34O5 |
| InChI | InChI=1S/C23H34O5/c1-5-16-6-8-18-17-7-9-20(25)23(14-28-15(2)24,13-11-21(26)27-4)19(17)10-12-22(16,18)3/h5,16-19H,1,6-14H2,2-4H3/t16-,17-,18-,19-,22+,23-/m0/s1 |
| InChIKey | UAGNMZDUATTXGU-HEVMPEIHSA-N |
| Molecular Weight | 390.520 g/mol |
| SMILES | [C@]1([C@@]2([C@@]([C@@]3(CC[C@@]([C@]3(CC2)C)(C=C)[H])[H])([H])CCC1=O)[H])(COC(=O)C)CCC(=O)OC |
| SPLASH | splash10-001i-0009000000-4d36b965a915e145e678 |
| Source of Spectrum | U1-2002-3253-1 |
| Synonyms | 3-[(3R,3aR,5aS,6R,9aS,9bS)-6-(acetyloxymethyl)-3-ethenyl-3a-methyl-7-oxo-1,2,3,4,5,5a,8,9,9a,9b-decahydrocyclopenta[a]naphthalen-6-yl]propanoic acid methyl ester methyl 3-[(3R,3aR,5aS,6R,9aS,9bS)-6-(acetyloxymethyl)-3-ethenyl-3a-methyl-7-oxo-1,2,3,4,5,5a,8,9,9a,9b-decahydrocyclopenta[a]naphthalen-6-yl]propanoate methyl 3-[(3R,3aR,5aS,6R,9aS,9bS)-6-(acetoxymethyl)-3a-methyl-7-oxo-3-vinyl-1,2,3,4,5,5a,8,9,9a,9b-decahydrocyclopenta[a]naphthalen-6-yl]propanoate methyl 3-[(3R,3aR,5aS,6R,9aS,9bS)-6-(acetyloxymethyl)-3-ethenyl-3a-methyl-7-oxidanylidene-1,2,3,4,5,5a,8,9,9a,9b-decahydrocyclopenta[a]naphthalen-6-yl]propanoate |
| Wiley ID | 1523189 |