| SpectraBase Compound ID | DbNhGWbgvem |
|---|---|
| InChI | InChI=1S/C37H84O8Si6/c1-28(41-47(7,8)9)22-23-31-29(24-30(25-37(31,2)3)42-48(10,11)12)26-38-36-35(45-51(19,20)21)34(44-50(16,17)18)33(43-49(13,14)15)32(40-36)27-39-46(4,5)6/h28-36H,22-27H2,1-21H3/t28-,29+,30+,31+,32-,33-,34+,35-,36-/m1/s1 |
| InChIKey | FSQFSLQUWLBXRM-OUZGNAJRSA-N |
| Mol Weight | 825.6 g/mol |
| Molecular Formula | C37H84O8Si6 |
| Exact Mass | 824.478179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | If0N4odcgAV |
|---|---|
| Name | Rhusonoside A, 6tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 824.478178867 u |
| Formula | C37H84O8Si6 |
| InChI | InChI=1S/C37H84O8Si6/c1-28(41-47(7,8)9)22-23-31-29(24-30(25-37(31,2)3)42-48(10,11)12)26-38-36-35(45-51(19,20)21)34(44-50(16,17)18)33(43-49(13,14)15)32(40-36)27-39-46(4,5)6/h28-36H,22-27H2,1-21H3/t28-,29+,30+,31+,32-,33-,34+,35-,36-/m1/s1 |
| InChIKey | FSQFSLQUWLBXRM-OUZGNAJRSA-N |
| Molecular Weight | 825.581 g/mol |
| SMILES | [C@@]1(OC[C@]2([C@@](C(C[C@](C2)(O[Si](C)(C)C)[H])(C)C)(CC[C@@](C)(O[Si](C)(C)C)[H])[H])[H])([C@](O[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@](O[Si](C)(C)C)([C@](O1)(CO[Si](C)(C)C)[H])[H])[H])[H])[H] |