| SpectraBase Compound ID | ISjwM10QC3a |
|---|---|
| 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/h8-10,19-21,24-28H,11-18H2,1-7H3/b9-8+/t20-,21-,24+,25?,26?,27?,28?,29+,30-/m1/s1 |
| InChIKey | YAXRKAKOIWXVHL-IEPVGZEKSA-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 | BT5PaNjO7qC |
|---|---|
| Name | Crinosterol-acetate |
| 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/h8-10,19-21,24-28H,11-18H2,1-7H3/b9-8+/t20-,21-,24+,25?,26?,27?,28?,29+,30-/m1/s1 |
| InChIKey | YAXRKAKOIWXVHL-IEPVGZEKSA-N |
| Molecular Weight | 440.712 g/mol |
| SMILES | [C@@]12(C(C3CC=C4[C@@](C3CC2)(CC[C@](OC(=O)C)(C4)[H])C)CCC1[C@@](\C=C\[C@](C(C)C)(C)[H])(C)[H])C |
| SPLASH | splash10-001i-9734000000-ae56a8e38e27caf78fdb |
| Source of Spectrum | SD-1992-0-0 |
| Synonyms | (3beta,22E,24S)-ergosta-5,22-dien-3-yl acetate |
| Wiley ID | 1384925 |