| SpectraBase Spectrum ID |
KWpiqTdZxXx |
| Name |
(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(1R)-3-(2-imidazolin-2-yl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol |
| Alternate Name(s) |
(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(1R)-3-(4,5-dihydro-1H-imidazol-2-yl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol
(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-4-(4,5-dihydro-1H-imidazol-2-yl)butan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H44N2O3 |
| InChI |
InChI=1S/C26H44N2O3/c1-15(4-7-23-27-10-11-28-23)18-5-6-19-24-20(14-22(31)26(18,19)3)25(2)9-8-17(29)12-16(25)13-21(24)30/h15-22,24,29-31H,4-14H2,1-3H3,(H,27,28)/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1 |
| InChIKey |
AGWLAOLHGPJIFU-HZAMXZRMSA-N |
| Molecular Weight |
432.649 g/mol |
| SMILES |
O[C@]1(C[C@@]2([C@@]3([C@](C[C@]([C@]2([C@]2([C@]1([C@@]([C@@](CCC1=NCCN1)(C)[H])(CC2)[H])C)[H])[H])(O)[H])(C[C@@](CC3)(O)[H])[H])C)[H])[H] |
| SPLASH |
splash10-000t-9000000000-cbf7f0795a45245c2731 |
| Source of Spectrum |
G-62-477-4 |
| Wiley ID |
749249 |
![(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(1R)-3-(2-imidazolin-2-yl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol](/api/spectrum/KWpiqTdZxXx/structure.png?h=300&w=458 "(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(1R)-3-(2-imidazolin-2-yl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol")
