| SpectraBase Compound ID | LusIEObHaHh |
|---|---|
| InChI | InChI=1S/C35H60O6/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/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21?,22?,24-,25?,26+,27?,28?,29+,30+,31-,32+,33?,34-,35+/m0/s1 |
| InChIKey | NPJICTMALKLTFW-INNXIZJASA-N |
| Mol Weight | 576.9 g/mol |
| Molecular Formula | C35H60O6 |
| Exact Mass | 576.43899 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4t3b74DMRrW |
|---|---|
| Name | .beta.-Sitosteryl-D-glucoside |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H60O6 |
| InChI | InChI=1S/C35H60O6/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/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21?,22?,24-,25?,26+,27?,28?,29+,30+,31-,32+,33?,34-,35+/m0/s1 |
| InChIKey | NPJICTMALKLTFW-INNXIZJASA-N |
| Molecular Weight | 576.859 g/mol |
| SMILES | O[C@]1([C@@]([C@@](CO)(OC([C@@]1(O)[H])O[C@]1(CC[C@@]2(C3CC[C@]4(C(C3CC=C2C1)CC[C@@]4(C(CCC(C(C)C)CC)C)[H])C)C)[H])[H])(O)[H])[H] |
| SPLASH | splash10-0002-0009000000-c9f090724a438787fa07 |
| Source of Spectrum | QA-48-379-28 |
| Wiley ID | 863419 |