| SpectraBase Compound ID | 123wa1nDhsJ |
|---|---|
| InChI | InChI=1S/C29H48O/c1-7-15-27(4,8-2)19-20(3)24-11-12-25-23-10-9-21-18-22(30)13-16-28(21,5)26(23)14-17-29(24,25)6/h8-9,20,22-26,30H,2,7,10-19H2,1,3-6H3/t20-,22+,23?,24?,25?,26?,27?,28+,29-/m1/s1 |
| InChIKey | UMFYTZUHJXOTSS-APXOQNFJSA-N |
| Mol Weight | 412.7 g/mol |
| Molecular Formula | C29H48O |
| Exact Mass | 412.370516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7JOfy5eqWco |
|---|---|
| Name | 23-vinyl-23-methyl-26,27-dinorergost-5-en-3.beta.-ol A |
| Alternate Name(s) | (2R,5S,15R)-14-[(2R)-4-ethenyl-4-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol |
| CAS Registry Number | 119879-62-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48O |
| InChI | InChI=1S/C29H48O/c1-7-15-27(4,8-2)19-20(3)24-11-12-25-23-10-9-21-18-22(30)13-16-28(21,5)26(23)14-17-29(24,25)6/h8-9,20,22-26,30H,2,7,10-19H2,1,3-6H3/t20-,22+,23?,24?,25?,26?,27?,28+,29-/m1/s1 |
| InChIKey | UMFYTZUHJXOTSS-APXOQNFJSA-N |
| Molecular Weight | 412.702 g/mol |
| SMILES | O[C@]1(CC[C@@]2(C3CC[C@]4(C(C3CC=C2C1)CCC4[C@@](CC(C=C)(CCC)C)(C)[H])C)C)[H] |
| SPLASH | splash10-0ir0-1079200000-0c1d4ccd6974fab44ba1 |
| Source of Spectrum | J-54-2124-63 |
| Wiley ID | 1374818 |