| SpectraBase Compound ID | 2z7DCfNoeSz |
|---|---|
| InChI | InChI=1S/C30H48O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h11,19,21,23-24,26-28H,3,8-10,12-18H2,1-2,4-7H3/t21-,23+,24+,26-,27+,28+,29+,30-/m1/s1 |
| InChIKey | MITHMFYJJFILDI-JVHUAAPISA-N |
| Mol Weight | 440.7 g/mol |
| Molecular Formula | C30H48O2 |
| Exact Mass | 440.365431 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HaHKklKRZ1r |
|---|---|
| Name | 3-.beta-acetoxy-5.alpha.-Ergosta-7,24(28)-diene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48O2 |
| InChI | InChI=1S/C30H48O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h11,19,21,23-24,26-28H,3,8-10,12-18H2,1-2,4-7H3/t21-,23+,24+,26-,27+,28+,29+,30-/m1/s1 |
| InChIKey | MITHMFYJJFILDI-JVHUAAPISA-N |
| Molecular Weight | 440.712 g/mol |
| SMILES | C=12[C@]3([C@]([C@]([C@@](CCC(=C)C(C)C)(C)[H])([H])CC3)(C)CC[C@@]2([C@]2(CC[C@](OC(=O)C)(C[C@@]2(CC1)[H])[H])C)[H])[H] |
| SPLASH | splash10-03di-0059200000-ab9e618e02e8a2290e2c |
| Source of Spectrum | KC-1990-2217-3 |
| Synonyms | 3.beta.-Acetoxy-24-methylene-5.alpha.-cholest-7-ene (3beta,5alpha)-ergosta-7,24(28)-dien-3-yl acetate 3-..beta.-acetoxy-5.alpha.-ergosta-7,24(28)-diene |
| Wiley ID | 1384930 |