| SpectraBase Spectrum ID |
JwVxg9frFs1 |
| Name |
1-(6,7-dimethoxyisoquinolin-1-yl)-3-((3R,8S,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)propan-1-one hydrochloride |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H46ClNO4 |
| InChI |
InChI=1S/C33H45NO4.ClH/c1-32-15-12-27-24(8-5-22-18-23(35)11-14-33(22,27)2)26(32)9-6-21(32)7-10-28(36)31-25-19-30(38-4)29(37-3)17-20(25)13-16-34-31;/h13,16-17,19,21-24,26-27,35H,5-12,14-15,18H2,1-4H3;1H/t21-,22?,23-,24+,26+,27+,32-,33+;/m1./s1 |
| InChIKey |
PPUNTKHHJNBPIC-OOXINIRUSA-N |
| Molecular Weight |
556.187 g/mol |
| SMILES |
Cl.O[C@@]1(CC[C@]2(C(C1)CC[C@@]1([C@@]2(CC[C@@]2([C@](CC[C@@]12[H])(CCC(c1c2c(ccn1)cc(c(c2)OC)OC)=O)[H])C)[H])[H])C)[H] |
| SPLASH |
splash10-0019-0950060000-f47712ee474cd6b1c860 |
| Source of Spectrum |
APC-312-323-16 |
| Wiley ID |
1791862 |
![1-(6,7-dimethoxyisoquinolin-1-yl)-3-((3R,8S,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)propan-1-one hydrochloride](/api/spectrum/JwVxg9frFs1/structure.png?h=300&w=458 "1-(6,7-dimethoxyisoquinolin-1-yl)-3-((3R,8S,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)propan-1-one hydrochloride")
