SpectraBase Compound ID | ARoBmAgdurm |
---|---|
InChI | InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3 |
InChIKey | KZJWDPNRJALLNS-UHFFFAOYSA-N |
Mol Weight | 414.7 g/mol |
Molecular Formula | C29H50O |
Exact Mass | 414.386166 g/mol |
SpectraBase Spectrum ID | 3Zghojco1LS |
---|---|
Name | Sitosterol |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H50O |
InChI | InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3 |
InChIKey | KZJWDPNRJALLNS-UHFFFAOYSA-N |
Ionization Type | EI-B |
Molecular Weight | 414.718 g/mol |
SMILES | OC1CC2=CCC3C(CCC4(C)C(C(CCC(CC)C(C)C)C)CCC34)C2(C)CC1 |
SPLASH | splash10-0a4l-9822000000-85ff72d6dd3fe0808897 |
Source of Spectrum | SRH-2022-5753-0 |
Wiley ID | 1827771 |