| SpectraBase Compound ID | AIHvkFB6j3j |
|---|---|
| InChI | InChI=1S/C15H18O7/c1-7(16)9-5-15(22-13(9)18)4-3-8-10(12(17)20-2)6-21-14(19)11(8)15/h3-5,7-8,10-11,14,16,19H,6H2,1-2H3/t7?,8-,10-,11-,14+,15-/m1/s1 |
| InChIKey | MWYGUUCBPMDIGE-MGKMQBBXSA-N |
| Mol Weight | 310.3 g/mol |
| Molecular Formula | C15H18O7 |
| Exact Mass | 310.105253 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EBHDW8FmdQA |
|---|---|
| Name | .alpha.-allamcidin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H18O7 |
| InChI | InChI=1S/C15H18O7/c1-7(16)9-5-15(22-13(9)18)4-3-8-10(12(17)20-2)6-21-14(19)11(8)15/h3-5,7-8,10-11,14,16,19H,6H2,1-2H3/t7?,8-,10-,11-,14+,15-/m1/s1 |
| InChIKey | MWYGUUCBPMDIGE-MGKMQBBXSA-N |
| Molecular Weight | 310.302 g/mol |
| SMILES | O[C@]1(OC[C@]([C@@]2([C@]1([C@]1(C=C(C(O)C)C(O1)=O)C=C2)[H])[H])(C(=O)OC)[H])[H] |
| SPLASH | splash10-03ds-0940000000-19f061ae4b27f9554d29 |
| Source of Spectrum | X2-53-1454-9 |
| Wiley ID | 1603727 |