| SpectraBase Compound ID | 5ofVanY9DIm |
|---|---|
| InChI | InChI=1S/C34H54O6/c1-19(2)20(3)7-8-21(4)25-11-12-26-24-10-9-22-17-23(13-15-33(22,5)27(24)14-16-34(25,26)6)39-32-31(38)30(37)29(36)28(18-35)40-32/h7-10,19-21,23,25-32,35-38H,11-18H2,1-6H3/b8-7+/t20-,21-,23+,25-,26?,27?,28-,29-,30+,31-,32-,33+,34-/m1/s1 |
| InChIKey | MKZPNGBJJJZJMI-YOZBEGSUSA-N |
| Mol Weight | 558.8 g/mol |
| Molecular Formula | C34H54O6 |
| Exact Mass | 558.392039 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8GHbCxD6fW7 |
|---|---|
| Name | ERGOSTERYL-3-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H54O6 |
| InChI | InChI=1S/C34H54O6/c1-19(2)20(3)7-8-21(4)25-11-12-26-24-10-9-22-17-23(13-15-33(22,5)27(24)14-16-34(25,26)6)39-32-31(38)30(37)29(36)28(18-35)40-32/h7-10,19-21,23,25-32,35-38H,11-18H2,1-6H3/b8-7+/t20-,21-,23+,25-,26?,27?,28-,29-,30+,31-,32-,33+,34-/m1/s1 |
| InChIKey | MKZPNGBJJJZJMI-YOZBEGSUSA-N |
| Literature Reference Author | J.W.BOK,L.LERMER,J.CHILTON,H.G.KLINGEMAN,G.H.N.TOWERS |
| Literature Reference Citation | PHYTOCHEM.,51,891(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00128-4 |
| Molecular Weight | 558.799 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN903 |