YAC_1R (Compound 9) Quercetol B.tocsy
URL: https://nmrxiv.org/D2144
Dataset description:
A secondary metabolite determined by NMR spectroscopic, mass spectrometric, and single-crystal X-ray diffractometric analyses.
Source: YAC_1R (Compound 9) Quercetol B.tocsy
Chemical Info
| InChI |
InChI=1S/C23H28O4/c1-15(2)11-12-17-19(24-3)14-21(26-5)22-20(25-4)13-18(27-23(17)22)16-9-7-6-8-10-16/h6-11,14,18,20H,12-13H2,1-5H3 |
| SMILES |
COC1=CC(OC)=C2C(=C1CC=C(C)C)OC(C1=CC=CC=C1)CC2OC |
| InChI Key |
QYAYIWOQUZDATC-UHFFFAOYSA-N |
| Molecular Formula |
C23H28O4 |
| Exact Mass |
368.500 g/mol |
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