| SpectraBase Spectrum ID |
5j6T7PWTXf1 |
| Name |
16,28-Secosolanid-5-ene-3,16-diol, 28-acetyl-, (3.beta.,16.beta.,22.alpha.,25.beta.)- |
| CAS Registry Number |
18098-03-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H47NO3 |
| InChI |
InChI=1S/C29H47NO3/c1-17-6-9-25(30(16-17)19(3)31)18(2)27-26(33)15-24-22-8-7-20-14-21(32)10-12-28(20,4)23(22)11-13-29(24,27)5/h7,17-18,21-27,32-33H,6,8-16H2,1-5H3/t17-,18+,21-,22+,23-,24-,25+,26-,27-,28-,29-/m0/s1 |
| InChIKey |
DLXYWVPYQPBPJB-XAKLIMFGSA-N |
| Molecular Weight |
457.699 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(=O)C)C[C@](CC4)(C)[H])[H])(C)[H])[H])(CC[C@]23[H])C)[H])[H])C1)C)[H] |
| SPLASH |
splash10-0007-4900000000-f6c0ad0cede57c5781ca |
| Source of Spectrum |
B-32-811-0 |
| Synonyms |
(22S,25R)-22,26-acetylepiminocholest-5-ene-3.beta.,16.beta.-diol
(3beta,16beta,20S)-20-[(2R,5S)-1-acetyl-5-methylpiperidinyl]pregn-5-ene-3,16-diol
3-Pipecoline, 1-acetyl-6-(3.beta.,16.beta.-dihydroxypregn-5-en-20.alpha.-yl)-, (3R,6S)-
Pregn-5-ene-3.beta.,16.beta.-diol, 20.alpha.-(1-acetyl-5-methyl-2-piperidyl)- |
| Wiley ID |
1389678 |
