| SpectraBase Compound ID | AYHjaC3CAdJ |
|---|---|
| InChI | InChI=1S/C21H30O4/c1-14-5-8-21(3)17(19(23)24-4)11-16(22)12-18(21)20(14,2)9-6-15-7-10-25-13-15/h7,10-11,13-14,16,18,22H,5-6,8-9,12H2,1-4H3/t14-,16?,18+,20-,21+/m1/s1 |
| InChIKey | JSKOGQSOLMLOJZ-PKONFMLCSA-N |
| Mol Weight | 346.47 g/mol |
| Molecular Formula | C21H30O4 |
| Exact Mass | 346.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | COPz84w1VCi |
|---|---|
| Name | Tinotofulin A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O4 |
| InChI | InChI=1S/C21H30O4/c1-14-5-8-21(3)17(19(23)24-4)11-16(22)12-18(21)20(14,2)9-6-15-7-10-25-13-15/h7,10-11,13-14,16,18,22H,5-6,8-9,12H2,1-4H3/t14-,16?,18+,20-,21+/m1/s1 |
| InChIKey | JSKOGQSOLMLOJZ-PKONFMLCSA-N |
| Molecular Weight | 346.467 g/mol |
| SMILES | OC1C=C([C@]2([C@]([C@@](CCc3cocc3)(C)[C@@](CC2)(C)[H])(C1)[H])C)C(=O)OC |
| SPLASH | splash10-00ea-9700000000-34ac785f619817addeb5 |
| Source of Spectrum | U-1993-326-1 |
| Synonyms | (5R,6R,8aR)-5-(2-Furan-2-yl-ethyl)-5,6,8a-trimethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydro-naphthalene-1-carboxylic acid methyl ester Methyl 5-[2'-(3''-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-3-hydroxy-5,6,8a-trimethyl-1-naphthalebnecarboxylate Methyl 5-[2'-(3''-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-3-oxo-5,6,8a-trimethyl-1-naphthalebnecarboxylate |
| Wiley ID | 764891 |