| SpectraBase Compound ID | KexibX2MAt8 |
|---|---|
| InChI | InChI=1S/C29H48O3/c1-7-29(32-31,19(2)3)17-12-20(4)24-10-11-25-23-9-8-21-18-22(30)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,19-20,22-26,30-31H,1,9-18H2,2-6H3/t20-,22?,23+,24-,25+,26+,27+,28-,29?/m1/s1 |
| InChIKey | WLNWTSOEOWZEGI-FFLHBEBOSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C29H48O3 |
| Exact Mass | 444.360345 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7uOkWnPFPR3 |
|---|---|
| Name | 24-Hydroperoxy-24-vinylcholesterol |
| Alternate Name(s) | 24-hydroperoxystigmasta-5,28-dien-3-ol (8S,9S,10R,13R,14S,17R)-17-[(2R)-5-hydroperoxy-5-propan-2-ylhept-6-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol (8S,9S,10R,13R,14S,17R)-17-[(2R)-5-(dioxidanyl)-5-propan-2-yl-hept-6-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48O3 |
| InChI | InChI=1S/C29H48O3/c1-7-29(32-31,19(2)3)17-12-20(4)24-10-11-25-23-9-8-21-18-22(30)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,19-20,22-26,30-31H,1,9-18H2,2-6H3/t20-,22?,23+,24-,25+,26+,27+,28-,29?/m1/s1 |
| InChIKey | WLNWTSOEOWZEGI-FFLHBEBOSA-N |
| Molecular Weight | 444.700 g/mol |
| SMILES | OC1CC[C@]2(C(=CC[C@]3([C@]4([C@@]([C@@]([C@@](CCC(OO)(C=C)C(C)C)(C)[H])(CC4)[H])(CC[C@]23[H])C)[H])[H])C1)C |
| SPLASH | splash10-0229-0095100000-b805567051c8ab6d5ce0 |
| Source of Spectrum | QA-38-503-1 |
| Wiley ID | 861381 |