| SpectraBase Spectrum ID |
5spTSaUhjRV |
| Name |
27-Nor-9,10-secocholesta-5,7,10(19)-trien-25-one, 3-hydroxy-, cyclic 1,2-ethanediyl acetal, (3.beta.,5Z,7E)- |
| CAS Registry Number |
100928-12-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H44O3 |
| InChI |
InChI=1S/C28H44O3/c1-20-9-12-24(29)19-23(20)11-10-22-8-6-15-27(3)25(13-14-26(22)27)21(2)7-5-16-28(4)30-17-18-31-28/h10-11,21,24-26,29H,1,5-9,12-19H2,2-4H3/b22-10+,23-11-/t21-,24+,25-,26+,27-/m1/s1 |
| InChIKey |
OENDLORDYIKLHJ-YMKPWUIQSA-N |
| Molecular Weight |
428.657 g/mol |
| SMILES |
O[C@@]1(C\C(=C\C=C\2[C@]3([C@@]([C@](CC3)([C@@](CCCC3(OCCO3)C)(C)[H])[H])(CCC2)C)[H])C(CC1)=C)[H] |
| SPLASH |
splash10-0006-9000000000-133882aa62c6c24e6f02 |
| Source of Spectrum |
J-51-1272-9 |
| Synonyms |
(3S,5Z,7E)-24-(2-methyl-1,3-dioxolan-2-yl)-9,10-secochola-5,7,10-trien-3-ol
Hydroxy ketal |
| Wiley ID |
1380892 |
