1.hsqc
Dataset description:
This dataset contains NMR spectra obtained for the sample -1 date: 2022-07-01T16:37:42.000Z isFt: true name: 1/1 phc0: 4.801669 phc1: 40.76558 type: NMR Spectrum DECIM: 2000 aqMod: 3...
Source: 1.hsqc
Chemical Info
| InChI | InChI=1S/C27H42O8/c1-13(29)17-6-7-18-16-5-4-14-10-15(34-25-24(33)23(32)22(31)20(12-28)35-25)8-9-26(14,2)19(16)11-21(30)27(17,18)3/h4,15-25,28,30-33H,5-12H2,1-3H3 |
|---|---|
| SMILES | CC(=O)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CC(O)C12C |
| InChI Key | HMDXOGQHGCUABA-UHFFFAOYSA-N |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 3, 2025 |
| Metadata last updated | February 3, 2025 |
| Created | February 3, 2025 |
| Format | HTML |
| License | Attribution-NonCommercial-ShareAlike 4.0 International |
| Id | 246291da-86cb-4e32-aefe-855ad1a3b98a |
| Package id | nmrxiv-d2871 |
| Resource type | HTML |
| State | active |