| SpectraBase Spectrum ID |
JL4MgANeeaZ |
| Name |
A-homo-4-methyl-4-azacholesta-5,7-dien-3-one |
| Alternate Name(s) |
(5aR,7aR,8R)-8-[(1R)-1,5-dimethylhexyl]-2,5a,7a-trimethyl-4,5,5a,5b,6,7,7a,8,9,10,10a,10b-dodecahydrocyclopenta[5,6]naphtho[2,1-c]azepin-3(2H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H45NO |
| InChI |
InChI=1S/C28H45NO/c1-19(2)8-7-9-20(3)23-12-13-24-22-11-10-21-18-29(6)26(30)15-17-27(21,4)25(22)14-16-28(23,24)5/h10-11,18-20,22-25H,7-9,12-17H2,1-6H3/t20-,22?,23-,24?,25?,27+,28-/m1/s1 |
| InChIKey |
MQCULQFWOVCDQL-UNUKYRCESA-N |
| Molecular Weight |
411.674 g/mol |
| SMILES |
[C@@]12(C(C3C=CC=4[C@@](C3CC2)(CCC(=O)N(C4)C)C)CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])C |
| SPLASH |
splash10-0bt9-9001500000-56450652334de8de311c |
| Source of Spectrum |
F-53-10575-11 |
| Wiley ID |
803161 |
