SpectraBase Spectrum ID |
JTekDnQpz3G |
Name |
5'-Aminothieno[2',3' : 2,3]-5.alpha.-cholestan-4'-carbonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H46N2S |
InChI |
InChI=1S/C30H46N2S/c1-18(2)7-6-8-19(3)24-11-12-25-21-10-9-20-15-22-23(17-31)28(32)33-27(22)16-30(20,5)26(21)13-14-29(24,25)4/h18-21,24-26H,6-16,32H2,1-5H3/t19-,20?,21?,24-,25?,26?,29-,30+/m1/s1 |
InChIKey |
LWDVCKJNDFQSTC-HEHSQJATSA-N |
Molecular Weight |
466.772 g/mol |
SMILES |
Nc1c(c2c(C[C@]3(C(C2)CCC2C4CC[C@@]([C@]4(CCC32)C)([C@@](CCCC(C)C)(C)[H])[H])C)s1)C#N |
SPLASH |
splash10-0uxr-0902700000-97a98d69d23384d49b57 |
Source of Spectrum |
D8-337-144-2 |
Synonyms |
(1R,10aS,12aR)-8-amino-1-[(1R)-1,5-dimethylhexyl]-10a,12a-dimethyl-2,3,3a,3b,4,5,5a,6,10,10a,10b,11,12,12a-tetradecahydro-1H-cyclopenta[7,8]phenanthro[3,2-b]thiophene-7-carbonitrile |
Wiley ID |
1551204 |