| SpectraBase Spectrum ID |
E2izOqIH6iL |
| Name |
Pregn-7-ene-20-carboxaldehyde, 3-(acetyloxy)-4-methyl-, (3.beta.,4.alpha.,5.alpha.,20S)- |
| CAS Registry Number |
63109-20-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H38O3 |
| InChI |
InChI=1S/C25H38O3/c1-15(14-26)19-8-9-21-18-6-7-20-16(2)23(28-17(3)27)11-13-25(20,5)22(18)10-12-24(19,21)4/h6,14-16,19-23H,7-13H2,1-5H3/t15-,16+,19-,20+,21+,22+,23+,24-,25+/m1/s1 |
| InChIKey |
UUNZMNDCUXPVKK-CIPUCBSASA-N |
| Molecular Weight |
386.576 g/mol |
| SMILES |
C1=2[C@@]([C@]3(CC[C@@]([C@]([C@@]3(CC2)[H])(C)[H])(OC(=O)C)[H])C)(CC[C@]2([C@]1(CC[C@@]2([C@@](C=O)(C)[H])[H])[H])C)[H] |
| SPLASH |
splash10-002r-0039000000-eacece818d8fc0fc492e |
| Source of Spectrum |
K-110-1529-0 |
| Synonyms |
(1R,2S,5S,6S,7S,11R,14R,15R)-2,6,15-trimethyl-14-[(2S)-1-oxopropan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-9-en-5-yl acetate
3.beta.-acetoxy-4.alpha.-methyl-23,24-dinor-5.alpha.-chol-7-en-22-al |
| Wiley ID |
1362924 |
