| SpectraBase Compound ID | JK8RsfXK4TC |
|---|---|
| InChI | InChI=1S/C42H80O7Si2/c1-9-10-11-12-13-14-15-16-17-18-19-23-26-41(49-51(6,7)8)39-30-29-38(44-33-45-39)40-28-27-36(47-40)24-21-20-22-25-37(48-50(3,4)5)32-35-31-34(2)46-42(35)43/h31,34,36-41H,9-30,32-33H2,1-8H3/t34-,36-,37-,38+,39-,40+,41-/m1/s1 |
| InChIKey | FHUXUGKXQLKRGG-PVLMOBSWSA-N |
| Mol Weight | 753.3 g/mol |
| Molecular Formula | C42H80O7Si2 |
| Exact Mass | 752.544258 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1fwn8PNRJnl |
|---|---|
| Name | 4,18-Trimethylsilyl-14,17-formaldehyde acetal derivative gigantetrocin A |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 752.544257979 u |
| Formula | C42H80O7Si2 |
| InChI | InChI=1S/C42H80O7Si2/c1-9-10-11-12-13-14-15-16-17-18-19-23-26-41(49-51(6,7)8)39-30-29-38(44-33-45-39)40-28-27-36(47-40)24-21-20-22-25-37(48-50(3,4)5)32-35-31-34(2)46-42(35)43/h31,34,36-41H,9-30,32-33H2,1-8H3/t34-,36-,37-,38+,39-,40+,41-/m1/s1 |
| InChIKey | FHUXUGKXQLKRGG-PVLMOBSWSA-N |
| Molecular Weight | 753.265 g/mol |
| SMILES | C=1(C(O[C@@](C1)(C)[H])=O)C[C@](O[Si](C)(C)C)(CCCCC[C@]1(O[C@]([C@]2(OCO[C@@]([C@](O[Si](C)(C)C)(CCCCCCCCCCCCCC)[H])(CC2)[H])[H])(CC1)[H])[H])[H] |