YAC_3P (Compound 19) Isoliquiritigenin.tocsy
Dataset description:
A secondary metabolite determined by NMR spectroscopic, mass spectrometric, and single-crystal X-ray diffractometric analyses.
Chemical Info
| InChI | InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H |
|---|---|
| SMILES | O=C(C=CC1=CC=C(O)C=C1)C1=C(O)C=C(O)C=C1 |
| InChI Key | DXDRHHKMWQZJHT-UHFFFAOYSA-N |
| Molecular Formula | C15H12O4 |
| Exact Mass | 256.250 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | May 15, 2024 |
| Metadata last updated | May 15, 2024 |
| Created | May 15, 2024 |
| Format | HTML |
| License | Attribution 4.0 International |
| Id | ff4e904e-becf-48e7-90d3-57ef8bf42e45 |
| Package id | nmrxiv-d2270 |
| Resource type | HTML |
| State | active |