| SpectraBase Spectrum ID |
EsaqRg8Pt4j |
| Name |
2-[2-[(8R,9S,13S,14S,17R)-3-[Tert-butyl(dimethyl)silyl]oxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[A]phenanthren-17-yl]ethyl]isoindole-1,3-dione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
559.311785464 u |
| Formula |
C34H45NO4Si |
| InChI |
InChI=1S/C34H45NO4Si/c1-32(2,3)40(5,6)39-23-12-14-24-22(21-23)11-13-26-25(24)15-17-33(4)29(26)16-18-34(33,38)19-20-35-30(36)27-9-7-8-10-28(27)31(35)37/h7-10,12,14,21,25-26,29,38H,11,13,15-20H2,1-6H3/t25-,26-,29+,33+,34-/m1/s1 |
| InChIKey |
ABLGVWSJKFWNHD-YVWPKHACSA-N |
| Molecular Weight |
559.822 g/mol |
| SMILES |
C1(N(C(C2=CC=CC=C12)=O)CC[C@]1([C@@]2([C@@]([C@@]3(CCC4=C([C@]3(CC2)[H])C=CC(O[Si](C(C)(C)C)(C)C)=C4)[H])([H])CC1)C)O)=O |
![2-[2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]isoindole-1,3-dione](/api/spectrum/EsaqRg8Pt4j/structure.png?h=300&w=458 "2-[2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]isoindole-1,3-dione")
