| SpectraBase Compound ID | E6hE1VM3P8C |
|---|---|
| InChI | InChI=1S/C35H58O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h8-9,11,20-24,26-33,36-39H,7,10,12-19H2,1-6H3/b9-8+/t21?,22-,23?,24-,26?,27?,28?,29+,30+,31-,32+,33+,34-,35+/m0/s1 |
| InChIKey | ITYGLICZKGWOPA-SYBZZBKDSA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C35H58O6 |
| Exact Mass | 574.42334 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JGBK0454TFn |
|---|---|
| Name | 3-BETA-O-BETA-D-GLUCOPYRANOSYL-SPINASTEROL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H58O6 |
| InChI | InChI=1S/C35H58O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h8-9,11,20-24,26-33,36-39H,7,10,12-19H2,1-6H3/b9-8+/t21?,22-,23?,24-,26?,27?,28?,29+,30+,31-,32+,33+,34-,35+/m0/s1 |
| InChIKey | ITYGLICZKGWOPA-SYBZZBKDSA-N |
| Literature Reference Author | D.D.C.F.GOMES,L.V.ALEGRIO |
| Literature Reference Citation | PHYTOCHEM.,49,1365(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00925-4 |
| Molecular Weight | 574.842 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU547 |