| SpectraBase Compound ID | 4qgqhu1jicf |
|---|---|
| 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/h10-11,20-22,24,26-33,36-39H,7-9,12-19H2,1-6H3/t21-,22+,24-,26?,27?,28?,29+,30+,31-,32+,33+,34-,35+/m0/s1 |
| InChIKey | WZAVRACQZPAQDM-ZSLJEJMHSA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C35H58O6 |
| Exact Mass | 574.42334 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Gzl7gMnpQ1z |
|---|---|
| Name | .beta.-Sitosterol-D-glucoside |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. 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/h10-11,20-22,24,26-33,36-39H,7-9,12-19H2,1-6H3/t21-,22+,24-,26?,27?,28?,29+,30+,31-,32+,33+,34-,35+/m0/s1 |
| InChIKey | WZAVRACQZPAQDM-ZSLJEJMHSA-N |
| Molecular Weight | 574.843 g/mol |
| SMILES | O[C@]1([C@@]([C@@](CO)(O[C@]([C@@]1(O)[H])(O[C@@]1(CC2=CC=C3C4[C@](C([C@](CC[C@](C(C)C)(CC)[H])(C)[H])CC4)(C)CCC3[C@]2(CC1)C)[H])[H])[H])(O)[H])[H] |
| SPLASH | splash10-06vj-0069300000-66acb86ec91d7a1cfdf2 |
| Source of Spectrum | QA-46-84-32 |
| Wiley ID | 863036 |