| SpectraBase Compound ID | 3yeZnHUNOyh |
|---|---|
| InChI | InChI=1S/C41H60O20/c1-2-3-4-5-6-7-9-12-22(46)13-10-8-11-14-28(49)59-38-35(55)37(29-21(17-42)15-23(47)16-24(29)48)56-27(20-45)36(38)60-41-39(33(53)31(51)26(19-44)58-41)61-40-34(54)32(52)30(50)25(18-43)57-40/h6-12,14-16,22,25-27,30-48,50-55H,2-5,13,17-20H2,1H3/b7-6+,10-8+,12-9+,14-11+/t22?,25-,26+,27-,30+,31-,32+,33-,34-,35+,36-,37+,38-,39+,40+,41-/m1/s1 |
| InChIKey | DEPSCDXHCFJSQZ-FUEAVXFLSA-N |
| Mol Weight | 872.9 g/mol |
| Molecular Formula | C41H60O20 |
| Exact Mass | 872.367794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2tag3Se5DKm |
|---|---|
| Name | FUSACANDIN-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H60O20 |
| InChI | InChI=1S/C41H60O20/c1-2-3-4-5-6-7-9-12-22(46)13-10-8-11-14-28(49)59-38-35(55)37(29-21(17-42)15-23(47)16-24(29)48)56-27(20-45)36(38)60-41-39(33(53)31(51)26(19-44)58-41)61-40-34(54)32(52)30(50)25(18-43)57-40/h6-12,14-16,22,25-27,30-48,50-55H,2-5,13,17-20H2,1H3/b7-6+,10-8+,12-9+,14-11+/t22?,25-,26+,27-,30+,31-,32+,33-,34-,35+,36-,37+,38-,39+,40+,41-/m1/s1 |
| InChIKey | DEPSCDXHCFJSQZ-FUEAVXFLSA-N |
| Literature Reference Author | J.E.HOCHLOWSKI,D.N.WHITTERN,A.BUKO,L.ALDER,J.B.MCALPINE |
| Literature Reference Citation | J.ANTIBIOTICS,48,614(1995) |
| Literature Reference DOI | 10.7164/antibiotics.48.614 |
| Molecular Weight | 872.915 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSW390 |