YAC_3D (Compound 21) Tephrowatsin A.hsqc
Dataset description:
A secondary metabolite determined by NMR spectroscopic, mass spectrometric, and single-crystal X-ray diffractometric analyses.
Chemical Info
InChI | InChI=1S/C22H26O4/c1-14(2)10-11-16-19(24-3)13-20(25-4)21-17(23)12-18(26-22(16)21)15-8-6-5-7-9-15/h5-10,13,17-18,23H,11-12H2,1-4H3 |
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SMILES | COC1=CC(OC)=C2C(=C1CC=C(C)C)OC(C1=CC=CC=C1)CC2O |
InChI Key | ADIMMCHZVYYGPW-UHFFFAOYSA-N |
Molecular Formula | C22H26O4 |
Exact Mass | 354.400 g/mol |
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Additional Information
Field | Value |
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Data last updated | May 15, 2024 |
Metadata last updated | May 15, 2024 |
Created | May 15, 2024 |
Format | HTML |
License | Attribution 4.0 International |
Id | 0fa5775d-26d9-4813-a729-bf36c3aac6e1 |
Package id | nmrxiv-d2262 |
Resource type | HTML |
State | active |