Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H22N2O2 |
| Molecular Weight | 286.3688 |
| Optical Activity | ( + ) |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=CC2=C1C=C(CCN3CCC[C@@H]3CO)NC2=O
InChI
InChIKey=JIODGUURCXVIDC-CQSZACIVSA-N
InChI=1S/C17H22N2O2/c1-12-4-2-6-15-16(12)10-13(18-17(15)21)7-9-19-8-3-5-14(19)11-20/h2,4,6,10,14,20H,3,5,7-9,11H2,1H3,(H,18,21)/t14-/m1/s1
| Molecular Formula | C17H22N2O2 |
| Molecular Weight | 286.3688 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:33:17 GMT 2025
by
admin
on
Mon Mar 31 18:33:17 GMT 2025
|
| Record UNII |
1RW94540W6
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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10424118
Created by
admin on Mon Mar 31 18:33:17 GMT 2025 , Edited by admin on Mon Mar 31 18:33:17 GMT 2025
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1RW94540W6
Created by
admin on Mon Mar 31 18:33:17 GMT 2025 , Edited by admin on Mon Mar 31 18:33:17 GMT 2025
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680223-64-7
Created by
admin on Mon Mar 31 18:33:17 GMT 2025 , Edited by admin on Mon Mar 31 18:33:17 GMT 2025
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PRIMARY |
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TARGET -> INHIBITOR |
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ENANTIOMER -> ENANTIOMER |
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![Structure of 3-[2-[(2S)-2-(Hydroxymethyl)-1-pyrrolidinyl]ethyl]-5-methyl-1(2H)-isoquinolinone](/img/4fc85d9c-7ce4-4085-a663-323634d19043.svg "Structure of 3-[2-[(2S)-2-(Hydroxymethyl)-1-pyrrolidinyl]ethyl]-5-methyl-1(2H)-isoquinolinone")
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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![Structure of 3-[2-[(2R)-2-(Hydroxymethyl)-1-pyrrolidinyl]ethyl]-5-methyl-1(2H)-isoquinolinone](/img/bd875faf-c734-4133-893d-2c360664afff.svg "Structure of 3-[2-[(2R)-2-(Hydroxymethyl)-1-pyrrolidinyl]ethyl]-5-methyl-1(2H)-isoquinolinone")