YAC_3D (Compound 21) Tephrowatsin A.c13
URL: https://nmrxiv.org/D2258
Dataset description:
A secondary metabolite determined by NMR spectroscopic, mass spectrometric, and single-crystal X-ray diffractometric analyses.
Source: YAC_3D (Compound 21) Tephrowatsin A.c13
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 |
| 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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