| SpectraBase Spectrum ID |
223sSNuN2fp |
| Name |
(3S,9S,10S,13R,14S)-17-[2-[(7-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
534.337691840 u |
| Formula |
C34H47ClN2O |
| InChI |
InChI=1S/C34H47ClN2O/c1-33-17-14-29-25(10-7-22-19-24(38)13-16-34(22,29)2)28(33)11-8-21(33)15-18-36-32-26-5-3-4-6-30(26)37-31-12-9-23(35)20-27(31)32/h9,12,20-22,24-25,28-29,38H,3-8,10-11,13-19H2,1-2H3,(H,36,37)/t21?,22?,24-,25?,28-,29-,33+,34-/m0/s1 |
| InChIKey |
NXNREODMJJUJTM-SFWRQVFRSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Molecular Weight |
535.216 g/mol |
| Reported Formula |
C34H47ClN2O |
| SMILES |
O[C@]1(CC[C@@]2([C@]3(CC[C@@]4(C(CCNC5=C6C(=NC7=C5CCCC7)C=CC(=C6)Cl)CC[C@]4(C3CCC2C1)[H])C)[H])C)[H] |
| SPLASH |
splash10-001j-0090070000-957c709691ead61810ab |
| Source of Spectrum |
WO2022191092A1 |
| Thin-Layer Chromatography |
0.35 (Ethyl acetate/Methanol/Diethyl amine, 100:10:1) |
| Wiley ID |
1892743 |
![(3S,9S,10S,13R,14S)-17-[2-[(7-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol](/api/spectrum/223sSNuN2fp/structure.png?h=300&w=458 "(3S,9S,10S,13R,14S)-17-[2-[(7-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol")
