| SpectraBase Spectrum ID |
DCiR7q2Actg |
| Name |
3,3-(Ethylenedioxy)-5.beta.-cholest-7-en-6-one |
| Alternate Name(s) |
(1'R,2'R,7'R,11'R,14'R,15'R)-2',15'-dimethyl-14'-[(2R)-6-methylheptan-2-yl]spiro[1,3-dioxolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan]-9'-en-8'-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H46O3 |
| InChI |
InChI=1S/C29H46O3/c1-19(2)7-6-8-20(3)22-9-10-23-21-17-26(30)25-18-29(31-15-16-32-29)14-13-28(25,5)24(21)11-12-27(22,23)4/h17,19-20,22-25H,6-16,18H2,1-5H3/t20-,22-,23+,24+,25+,27-,28-/m1/s1 |
| InChIKey |
FQEIWJALJDSKBJ-UFESQAOXSA-N |
| Molecular Weight |
442.684 g/mol |
| SMILES |
C1=2[C@@]([C@]3(CCC4(C[C@]3(C(C2)=O)[H])OCCO4)C)(CC[C@]2([C@]1(CC[C@@]2([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H] |
| SPLASH |
splash10-0005-7100900000-ef0a963445bd13764cc7 |
| Source of Spectrum |
F-47-7066-8 |
| Wiley ID |
1385525 |
