| SpectraBase Compound ID | 3YO9HfqaCdq |
|---|---|
| InChI | InChI=1S/C28H24O4/c29-25-14-9-21-4-3-20-8-13-24(27(31)16-20)23-12-7-19(15-26(23)30)2-1-18-5-10-22(11-6-18)32-28(25)17-21/h5-17,29-31H,1-4H2 |
| InChIKey | LEEUWLLOFRIZOI-UHFFFAOYSA-N |
| Mol Weight | 424.5 g/mol |
| Molecular Formula | C28H24O4 |
| Exact Mass | 424.167459 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B3raMpgNHNY |
|---|---|
| Name | Polymorphatin A |
| Alternate Name(s) | 12-Oxapentacyclo[18.2.2.2(2,5).2(8,11),1(13,17)]nonacosa-1(22),2,4,8,10,13(25),14,16,20,23,26,28-dodecaene-3,14,22-triol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H24O4 |
| InChI | InChI=1S/C28H24O4/c29-25-14-9-21-4-3-20-8-13-24(27(31)16-20)23-12-7-19(15-26(23)30)2-1-18-5-10-22(11-6-18)32-28(25)17-21/h5-17,29-31H,1-4H2 |
| InChIKey | LEEUWLLOFRIZOI-UHFFFAOYSA-N |
| Molecular Weight | 424.496 g/mol |
| SMILES | Oc1c2-c3c(cc(CCc4ccc(Oc5cc(CCc(c1)cc2)ccc5O)cc4)cc3)O |
| SPLASH | splash10-00di-0000900000-191ed49645e8c35b472e |
| Source of Spectrum | H-90-752-1 |
| Wiley ID | 1590685 |