| SpectraBase Spectrum ID |
3cuuDbINAO |
| Name |
(25R,S)-3.beta.-Acetoxy-N,N-dimethylcholesta-5,22-dien-26-amide |
| CAS Registry Number |
80925-45-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H49NO3 |
| InChI |
InChI=1S/C31H49NO3/c1-20(9-8-10-21(2)29(34)32(6)7)26-13-14-27-25-12-11-23-19-24(35-22(3)33)15-17-30(23,4)28(25)16-18-31(26,27)5/h8-9,11,20-21,24-28H,10,12-19H2,1-7H3/b9-8+/t20-,21?,24+,25?,26-,27+,28?,30+,31-/m1/s1 |
| InChIKey |
PZVCHJGJPOEUMV-WNJLZWGISA-N |
| Molecular Weight |
483.737 g/mol |
| SMILES |
[C@@]12([C@](C3CC=C4[C@@](C3CC2)(CC[C@](OC(=O)C)(C4)[H])C)(CC[C@@]1([C@@](\C=C\CC(C(N(C)C)=O)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-00xr-6900700000-2bf11e00b27aea5f0064 |
| Source of Spectrum |
J-47-1723-0 |
| Synonyms |
(3beta,22E)-26-(dimethylamino)-26-oxocholesta-5,22-dien-3-yl acetate |
| Wiley ID |
1395879 |
