| SpectraBase Compound ID | KTKp3fzdKCs |
|---|---|
| InChI | InChI=1S/C23H26O10/c1-10-8-23(28)21-22(4,33-21)9-13-6-15(20(27)31-13)16(30-12(3)24)7-14(11(2)19(26)29-5)18(32-23)17(10)25/h6,8,13-14,16,18,21,28H,2,7,9H2,1,3-5H3/t13-,14-,16-,18+,21+,22-,23+/m1/s1 |
| InChIKey | ZBWYJRQHHPDMIG-KFPASVQESA-N |
| Mol Weight | 462.45 g/mol |
| Molecular Formula | C23H26O10 |
| Exact Mass | 462.152597 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | opgOfJ440 |
|---|---|
| Name | Bipinnatin O |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H26O10 |
| InChI | InChI=1S/C23H26O10/c1-10-8-23(28)21-22(4,33-21)9-13-6-15(20(27)31-13)16(30-12(3)24)7-14(11(2)19(26)29-5)18(32-23)17(10)25/h6,8,13-14,16,18,21,28H,2,7,9H2,1,3-5H3/t13-,14-,16-,18+,21+,22-,23+/m1/s1 |
| InChIKey | ZBWYJRQHHPDMIG-KFPASVQESA-N |
| Molecular Weight | 462.451 g/mol |
| SMILES | O[C@]12[C@@]3([C@](C[C@@]4(OC(=O)C(=C4)[C@](OC(=O)C)(C[C@@]([C@@](O1)([H])C(C(=C2)C)=O)(C(C(=O)OC)=C)[H])[H])[H])(C)O3)[H] |
| SPLASH | splash10-0gbi-2911000000-70b1243d332a3503f830 |
| Source of Spectrum | G4-71-388-8 |
| Wiley ID | 1694952 |