| SpectraBase Spectrum ID |
K4BtYJyBNkb |
| Name |
Cholest-4-en-3-one, 2-nitro-, (2.alpha.)- |
| CAS Registry Number |
123764-13-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H43NO3 |
| InChI |
InChI=1S/C27H43NO3/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-25(29)24(28(30)31)16-27(19,5)23(20)13-14-26(21,22)4/h15,17-18,20-24H,6-14,16H2,1-5H3/t18-,20+,21-,22+,23+,24-,26-,27+/m1/s1 |
| InChIKey |
BPHDQSRGBWKPAT-USVQCIGHSA-N |
| Molecular Weight |
429.645 g/mol |
| SMILES |
[C@@]12(C(=CC([C@@](C2)(N(=O)=O)[H])=O)CC[C@]2([C@@]3(CC[C@@]([C@]3(CC[C@]12[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])C |
| SPLASH |
splash10-05gj-8902100000-e76c1ba2b38738de0a7a |
| Source of Spectrum |
AJ-62-1344-2 |
| Synonyms |
(2alpha)-2-nitrocholest-4-en-3-one
2.alpha.-Nitrocholest-4-en-3-one |
| Wiley ID |
1381243 |
