Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H32N6OSi.C18H14O8 |
| Molecular Weight | 794.9242 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@H](OC(=O)C2=CC=CC=C2)C(O)=O.C[Si](C)(C)CCOCN3C=CC4=C(N=CN=C34)C5=CN(N=C5)[C@H](CC#N)C6CCCC6
InChI
InChIKey=QSAALLKTEBWYGD-FFLVPEHISA-N
InChI=1S/C23H32N6OSi.C18H14O8/c1-31(2,3)13-12-30-17-28-11-9-20-22(25-16-26-23(20)28)19-14-27-29(15-19)21(8-10-24)18-6-4-5-7-18;19-15(20)13(25-17(23)11-7-3-1-4-8-11)14(16(21)22)26-18(24)12-9-5-2-6-10-12/h9,11,14-16,18,21H,4-8,12-13,17H2,1-3H3;1-10,13-14H,(H,19,20)(H,21,22)/t21-;13-,14-/m10/s1
| Molecular Formula | C23H32N6OSi |
| Molecular Weight | 436.6253 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C18H14O8 |
| Molecular Weight | 358.299 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 20:17:11 GMT 2025
by
admin
on
Wed Apr 02 20:17:11 GMT 2025
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| Record UNII |
5ZD49H6XT7
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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134714823
Created by
admin on Wed Apr 02 20:17:11 GMT 2025 , Edited by admin on Wed Apr 02 20:17:11 GMT 2025
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5ZD49H6XT7
Created by
admin on Wed Apr 02 20:17:11 GMT 2025 , Edited by admin on Wed Apr 02 20:17:11 GMT 2025
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PRIMARY | |||
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1236033-04-7
Created by
admin on Wed Apr 02 20:17:11 GMT 2025 , Edited by admin on Wed Apr 02 20:17:11 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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PARENT -> SALT/SOLVATE |
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![Structure of ?-Cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-pyrazole-1-propanenitrile, (?R)-](/img/4efec9a4-0bb5-411d-8125-3d862c615dcd.svg "Structure of ?-Cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-pyrazole-1-propanenitrile, (?R)-")