11_AEIII-041E_C1_C3_C17_a_triol_08.23.2024_FULL.tocsy
Dataset description:
This dataset contains NMR spectra obtained for the sample -11_AEIII-041E_C1_C3_C17_a_triol_08.23.2024_FULL date: 2024-08-24T01:26:23.000Z isFt: true name:...
Source: 11_AEIII-041E_C1_C3_C17_a_triol_08.23.2024_FULL.tocsy
Chemical Info
| InChI | InChI=1S/C19H30O3/c1-18-8-7-15-13(14(18)5-6-16(18)21)4-3-11-9-12(20)10-17(22)19(11,15)2/h9,12-17,20-22H,3-8,10H2,1-2H3/t12-,13?,14?,15?,16+,17+,18+,19+/m1/s1 |
|---|---|
| SMILES | C[C@]12CCC3C(CCC4=C[C@@H](O)C[C@H](O)[C@@]43C)C1CC[C@@H]2O |
| InChI Key | WQJPXGINJISIRJ-YAUITSCLSA-N |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | March 22, 2025 |
| Metadata last updated | March 22, 2025 |
| Created | March 22, 2025 |
| Format | HTML |
| License | CC0 1.0 Legal Code |
| Id | 647aebe4-0670-4492-8fec-c1081204937a |
| Package id | nmrxiv-d4330 |
| Resource type | HTML |
| State | active |