| SpectraBase Spectrum ID |
3UnlV8ZJSa |
| Name |
3-(Hydroxymethylene)-5.alpha.-cholestan-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H46O2 |
| InChI |
InChI=1S/C28H46O2/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-21-15-20(17-29)26(30)16-28(21,5)25(22)13-14-27(23,24)4/h17-19,21-25,29H,6-16H2,1-5H3/b20-17-/t19-,21+,22+,23-,24+,25+,27-,28+/m1/s1 |
| InChIKey |
KSJHGRZGVZHOET-RTSMANDKSA-N |
| Molecular Weight |
414.674 g/mol |
| SMILES |
O\C=C\1C[C@]2([C@@]([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC2)[H])(CC1=O)C)[H] |
| SPLASH |
splash10-0aou-9110100000-7cb648675e19e75109e6 |
| Source of Spectrum |
U-1995-895-11 |
| Synonyms |
(5alpha)-3-(hydroxymethylene)cholestan-2-one
3-(Hydroxymethylene)-5.alpha.-cholestan-2.beta.-one |
| Wiley ID |
766875 |
