| SpectraBase Compound ID | JcRhXC9mYbz |
|---|---|
| InChI | InChI=1S/C32H50O3/c1-20(33)35-25-11-12-30(7)24(28(25,4)5)10-13-32(9)26(30)23(34)18-21-22-19-27(2,3)14-15-29(22,6)16-17-31(21,32)8/h18,22,24-26H,10-17,19H2,1-9H3/t22-,24?,25+,26-,29-,30+,31-,32-/m1/s1 |
| InChIKey | SOINDUWJQBFDIH-ZHSRKVRGSA-N |
| Mol Weight | 482.7 g/mol |
| Molecular Formula | C32H50O3 |
| Exact Mass | 482.375995 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FdyKtlzLj04 |
|---|---|
| Name | 3.beta.-Acetoxy-12-oleanen-11-one |
| Alternate Name(s) | (3beta,18alpha)-11-oxoolean-12-en-3-yl acetate |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H50O3 |
| InChI | InChI=1S/C32H50O3/c1-20(33)35-25-11-12-30(7)24(28(25,4)5)10-13-32(9)26(30)23(34)18-21-22-19-27(2,3)14-15-29(22,6)16-17-31(21,32)8/h18,22,24-26H,10-17,19H2,1-9H3/t22-,24?,25+,26-,29-,30+,31-,32-/m1/s1 |
| InChIKey | SOINDUWJQBFDIH-ZHSRKVRGSA-N |
| Molecular Weight | 482.749 g/mol |
| SMILES | C1=2[C@]([C@@]3(CCC4[C@@]([C@]3(C(C2)=O)[H])(CC[C@](OC(=O)C)(C4(C)C)[H])C)C)(CC[C@@]2([C@@]1(CC(CC2)(C)C)[H])C)C |
| SPLASH | splash10-03di-0090000000-c9adb7095d6a601dcbb7 |
| Source of Spectrum | QA-44-323-8 |
| Wiley ID | 862440 |