Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H22N2O.C4H4O4 |
| Molecular Weight | 410.4629 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.CC1=CC=C(C=C1)C2=NC=C(O[C@H]3CN4CCC3CC4)C=C2
InChI
InChIKey=DRUSIIXXBPKMAT-UTOQZODRSA-N
InChI=1S/C19H22N2O.C4H4O4/c1-14-2-4-15(5-3-14)18-7-6-17(12-20-18)22-19-13-21-10-8-16(19)9-11-21;5-3(6)1-2-4(7)8/h2-7,12,16,19H,8-11,13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t19-;/m0./s1
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C19H22N2O |
| Molecular Weight | 294.3908 |
| 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
Sat Dec 16 05:31:05 GMT 2023
by
admin
on
Sat Dec 16 05:31:05 GMT 2023
|
| Record UNII |
TJ8STM12NH
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Code | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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TJ8STM12NH
Created by
admin on Sat Dec 16 05:31:05 GMT 2023 , Edited by admin on Sat Dec 16 05:31:05 GMT 2023
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PRIMARY | |||
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71500421
Created by
admin on Sat Dec 16 05:31:05 GMT 2023 , Edited by admin on Sat Dec 16 05:31:05 GMT 2023
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1419523-67-3
Created by
admin on Sat Dec 16 05:31:05 GMT 2023 , Edited by admin on Sat Dec 16 05:31:05 GMT 2023
|
PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |