AEIV-059B_1_3_17_b_triol_10.16.2024.cosy
URL: https://nmrxiv.org/D4247
Dataset description:
This dataset contains NMR spectra obtained for the sample -AEIV-059B_1_3_17_b_triol_10.16.2024 date: 2024-10-16T15:05:37.000Z isFt: true name: AEIV-059B_1_3_17_b_triol_10.16.2024/1 phc0:...
Source: AEIV-059B_1_3_17_b_triol_10.16.2024.cosy
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-ZHBZUFJZSA-N |
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