| SpectraBase Spectrum ID |
h5WoI49n8v |
| Name |
16,28-Secosolanid-5-ene-3,16-diol, 28-chloro-, (3.beta.,16.beta.,22.alpha.,25.beta.)- |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H44ClNO2 |
| InChI |
InChI=1S/C27H44ClNO2/c1-16-5-8-23(29(28)15-16)17(2)25-24(31)14-22-20-7-6-18-13-19(30)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-25,30-31H,5,7-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23+,24-,25-,26-,27-/m0/s1 |
| InChIKey |
MTCXONZFBQCPLG-OQFNDJACSA-N |
| Molecular Weight |
450.107 g/mol |
| SMILES |
O[C@]1(CC[C@]2(C(=CC[C@]3([C@]4([C@@]([C@]([C@](C4)(O)[H])([C@@]([C@@]4(N(C[C@](CC4)(C)[H])Cl)[H])(C)[H])[H])(CC[C@]23[H])C)[H])[H])C1)C)[H] |
| SPLASH |
splash10-03dr-2900100000-b6615b498f1cc5e273d4 |
| Source of Spectrum |
B-32-812-0 |
| Synonyms |
(22S,25R)-22,26-chloroepiminocholest-5-ene-3.beta.,16.beta.-diol
(3beta,16beta,20S)-20-[(2R,5S)-1-chloro-5-methylpiperidinyl]pregn-5-ene-3,16-diol
N-Chlorodihydrosolasodine A
N-Chlorosolaverbascine
Pregn-5-ene-3.beta.,16.beta.-diol, 20.alpha.-((2S,5R)-1-chloro-5-methyl-2-piperidyl)- |
| Wiley ID |
1387491 |
