| SpectraBase Compound ID | EpxUm5VnFLs |
|---|---|
| InChI | InChI=1S/C41H63NO12/c1-14-15-16-23(3)37(54-41(42)48)28(8)38(51-32(12)45)26(6)20-22(2)19-25(5)36(50-31(11)44)24(4)17-18-34(49-30(10)43)21-35-27(7)39(52-33(13)46)29(9)40(47)53-35/h14-19,23-29,34-39H,1,20-21H2,2-13H3,(H2,42,48)/b16-15-,18-17-,22-19-/t23-,24-,25-,26-,27-,28+,29+,34+,35-,36-,37-,38+,39-/m0/s1 |
| InChIKey | PWBSZAOOBIXHLV-BLNDBFJPSA-N |
| Mol Weight | 761.9 g/mol |
| Molecular Formula | C41H63NO12 |
| Exact Mass | 761.435026 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7fRMqBqXnPz |
|---|---|
| Name | DISCODERMOLIDE-3,7,11,17-TETRAACETATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H63NO12 |
| InChI | InChI=1S/C41H63NO12/c1-14-15-16-23(3)37(54-41(42)48)28(8)38(51-32(12)45)26(6)20-22(2)19-25(5)36(50-31(11)44)24(4)17-18-34(49-30(10)43)21-35-27(7)39(52-33(13)46)29(9)40(47)53-35/h14-19,23-29,34-39H,1,20-21H2,2-13H3,(H2,42,48)/b16-15-,18-17-,22-19-/t23-,24-,25-,26-,27-,28+,29+,34+,35-,36-,37-,38+,39-/m0/s1 |
| InChIKey | PWBSZAOOBIXHLV-BLNDBFJPSA-N |
| Literature Reference Author | S.P.GUNASEKERA,R.E.LONGLEY,R.A.ISBRUCKER |
| Literature Reference Citation | J.NAT.PROD.,64,171(2001) |
| Literature Reference DOI | 10.1021/np000423e |
| Molecular Weight | 761.951 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU3807 |