| SpectraBase Spectrum ID |
LEgGYAXS2BL |
| Name |
Cholesta-1,4,6-trien-3-one, 25-[(tetrahydro-2H-pyran-2-yl)oxy]- |
| Alternate Name(s) |
25-(tetrahydro-2H-pyran-2-yl)oxy-1,4,6-cholestatrien-3-one
25-(tetrahydro-2H-pyran-2-yloxy)cholesta-1,4,6-trien-3-one |
| CAS Registry Number |
80239-46-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H48O3 |
| InChI |
InChI=1S/C32H48O3/c1-22(9-8-17-30(2,3)35-29-10-6-7-20-34-29)26-13-14-27-25-12-11-23-21-24(33)15-18-31(23,4)28(25)16-19-32(26,27)5/h11-12,15,18,21-22,25-29H,6-10,13-14,16-17,19-20H2,1-5H3/t22-,25+,26-,27+,28+,29?,31+,32-/m1/s1 |
| InChIKey |
XHIGTJXWERTOCG-WYZSOFTDSA-N |
| Molecular Weight |
480.733 g/mol |
| SMILES |
[C@@]12(C(C=C[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@]13[H])C)([C@@](CCCC(OC1OCCCC1)(C)C)(C)[H])[H])[H])[H])=CC(C=C2)=O)C |
| SPLASH |
splash10-0a4r-9522000000-f2ee9db0131366ee2543 |
| Source of Spectrum |
H-64-1880-0 |
| Wiley ID |
1395320 |
![Cholesta-1,4,6-trien-3-one, 25-[(tetrahydro-2H-pyran-2-yl)oxy]-](/api/spectrum/LEgGYAXS2BL/structure.png?h=300&w=458 "Cholesta-1,4,6-trien-3-one, 25-[(tetrahydro-2H-pyran-2-yl)oxy]-")
