| SpectraBase Compound ID | CSKaX8CG9mF |
|---|---|
| InChI | InChI=1S/C32H50O4/c1-19(2)20(3)9-10-21(4)26-11-12-27-25-18-30(36-23(6)34)29-17-24(35-22(5)33)13-15-32(29,8)28(25)14-16-31(26,27)7/h18-19,21,24,26-30H,3,9-17H2,1-2,4-8H3/t21-,24+,26-,27+,28+,29-,30+,31-,32-/m1/s1 |
| InChIKey | NOUHKPOZRIZYIY-RCIUYAGLSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C32H50O4 |
| Exact Mass | 498.37091 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8DNpqsdrnUy |
|---|---|
| Name | 24-Methylene-5.alpha.-cholest-7-ene-3.beta.,6.alpha.-diol - Diacetate |
| Alternate Name(s) | (3beta,5alpha,6alpha)-3-(acetyloxy)ergosta-7,24(28)-dien-6-yl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H50O4 |
| InChI | InChI=1S/C32H50O4/c1-19(2)20(3)9-10-21(4)26-11-12-27-25-18-30(36-23(6)34)29-17-24(35-22(5)33)13-15-32(29,8)28(25)14-16-31(26,27)7/h18-19,21,24,26-30H,3,9-17H2,1-2,4-8H3/t21-,24+,26-,27+,28+,29-,30+,31-,32-/m1/s1 |
| InChIKey | NOUHKPOZRIZYIY-RCIUYAGLSA-N |
| Molecular Weight | 498.748 g/mol |
| SMILES | C1=2[C@@]([C@]3(CC[C@](OC(=O)C)(C[C@@]3([C@](C2)(OC(=O)C)[H])[H])[H])C)(CC[C@]2([C@]1(CC[C@@]2([C@@](CCC(=C)C(C)C)(C)[H])[H])[H])C)[H] |
| SPLASH | splash10-0imi-0098100000-a2f23b6e98f508e3699a |
| Source of Spectrum | X2-49-783-3 |
| Wiley ID | 1602002 |