| SpectraBase Spectrum ID |
FbagCo1LlPe |
| Name |
(22s,23z)-de-a,b-8.beta.-(benzoyloxy)-25-[(methoxymethyl)oxy]chlest-23-en-22-ol |
| CAS Registry Number |
100937-70-0 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H40O5 |
| InChI |
InChI=1S/C27H40O5/c1-19(23(28)15-17-26(2,3)31-18-30-5)21-13-14-22-24(12-9-16-27(21,22)4)32-25(29)20-10-7-6-8-11-20/h6-8,10-11,15,17,19,21-24,28H,9,12-14,16,18H2,1-5H3/b17-15+/t19-,21?,22?,23-,24-,27+/m0/s1 |
| InChIKey |
WMLOBCDEOSZZAO-IFBYOBHXSA-N |
| Molecular Weight |
444.612 g/mol |
| SMILES |
O[C@@](\C=C\C(OCOC)(C)C)([C@](C1[C@@]2(C([C@@](OC(=O)c3ccccc3)(CCC2)[H])CC1)C)(C)[H])[H] |
| SPLASH |
splash10-03di-0910000000-bda3ded94c3b75dc03f0 |
| Source of Spectrum |
J-51-1267-9 |
| Synonyms |
(4S,7aR)-1-[(1S,2S,3E)-2-hydroxy-5-(methoxymethoxy)-1,5-dimethyl-3-hexenyl]-7a-methyloctahydro-1H-inden-4-yl benzoate |
| Wiley ID |
1386108 |
![(22s,23z)-de-a,b-8.beta.-(benzoyloxy)-25-[(methoxymethyl)oxy]chlest-23-en-22-ol](/api/spectrum/FbagCo1LlPe/structure.png?h=300&w=458 "(22s,23z)-de-a,b-8.beta.-(benzoyloxy)-25-[(methoxymethyl)oxy]chlest-23-en-22-ol")
