| SpectraBase Compound ID | A0rWuksNEVu |
|---|---|
| InChI | InChI=1S/C28H36O7/c1-16-8-10-21-27(3,4)22(34-17(2)29)12-13-28(21,5)19(16)15-33-25-20(31-6)14-18-9-11-23(30)35-24(18)26(25)32-7/h8-9,11,14,19,21-22H,10,12-13,15H2,1-7H3/t19-,21-,22+,28+/m1/s1 |
| InChIKey | YMIXTMQQHRBULF-CNBBWRMGSA-N |
| Mol Weight | 484.6 g/mol |
| Molecular Formula | C28H36O7 |
| Exact Mass | 484.246103 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Jtr3J5AB8tB |
|---|---|
| Name | Acetyl-isodrimartol A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H36O7 |
| InChI | InChI=1S/C28H36O7/c1-16-8-10-21-27(3,4)22(34-17(2)29)12-13-28(21,5)19(16)15-33-25-20(31-6)14-18-9-11-23(30)35-24(18)26(25)32-7/h8-9,11,14,19,21-22H,10,12-13,15H2,1-7H3/t19-,21-,22+,28+/m1/s1 |
| InChIKey | YMIXTMQQHRBULF-CNBBWRMGSA-N |
| Molecular Weight | 484.589 g/mol |
| SMILES | [C@]12([C@@](C(C)(C)[C@](CC2)(OC(=O)C)[H])(CC=C([C@]1(COc1c(c2OC(=O)C=Cc2cc1OC)OC)[H])C)[H])C |
| SPLASH | splash10-0fkc-3980000000-dc68acfde77d6262e4e5 |
| Source of Spectrum | X2-46-516-5 |
| Wiley ID | 1601221 |