| SpectraBase Compound ID | 6388NwMHLAg |
|---|---|
| InChI | InChI=1S/C20H32O5/c1-13-6-5-10-19(3,24)17(22)12-15-9-11-20(4,16(21)8-7-13)25-18(23)14(15)2/h6,15-17,21-22,24H,2,5,7-12H2,1,3-4H3/b13-6+/t15-,16+,17-,19+,20-/m1/s1 |
| InChIKey | JLCJNFREUBTKDT-WRHAGOLESA-N |
| Mol Weight | 352.5 g/mol |
| Molecular Formula | C20H32O5 |
| Exact Mass | 352.224974 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7G0dAUXkYcu |
|---|---|
| Name | Capillolide |
| Alternate Name(s) | (1R,3R,4S,11S,12R)-3,4,11-trihydroxy-4,8,12-trimethyl-15-methylene-13-oxabicyclo[10.3.2]heptadec-7-en-14-one (1R,3R,4S,7E,11S,12R)-3,4,11-trihydroxy-4,8,12-trimethyl-15-methylene-13-oxabicyclo[10.3.2]heptadec-7-en-14-one (1R,3R,4S,7E,11S,12R)-3,4,11-trihydroxy-4,8,12-trimethyl-15-methylidene-13-oxabicyclo[10.3.2]heptadec-7-en-14-one (1R,3R,4S,7E,11S,12R)-4,8,12-trimethyl-15-methylidene-3,4,11-tris(oxidanyl)-13-oxabicyclo[10.3.2]heptadec-7-en-14-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O5 |
| InChI | InChI=1S/C20H32O5/c1-13-6-5-10-19(3,24)17(22)12-15-9-11-20(4,16(21)8-7-13)25-18(23)14(15)2/h6,15-17,21-22,24H,2,5,7-12H2,1,3-4H3/b13-6+/t15-,16+,17-,19+,20-/m1/s1 |
| InChIKey | JLCJNFREUBTKDT-WRHAGOLESA-N |
| Molecular Weight | 352.471 g/mol |
| SMILES | O[C@@]1(C[C@@]2(C(C(O[C@@]([C@](CC\C(=C\CC[C@@]1(O)C)C)(O)[H])(CC2)C)=O)=C)[H])[H] |
| SPLASH | splash10-0pbc-5913000000-c8b3ca5b0b4ba43abaec |
| Source of Spectrum | G4-63-1544-1 |
| Wiley ID | 1608663 |