Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C17H23NO3.C6H8O7 |
| Molecular Weight | 481.4929 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 3 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3
InChI
InChIKey=PVFKXEKWGWYDSO-RIMUKSHESA-N
InChI=1S/C17H23NO3.C6H8O7/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-6,13-16,19H,7-11H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t13-,14+,15+,16?;
| Molecular Formula | C17H23NO3 |
| Molecular Weight | 289.3694 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C6H8O7 |
| Molecular Weight | 192.1235 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:47:18 UTC 2023
by
admin
on
Fri Dec 15 15:47:18 UTC 2023
|
| Record UNII |
058DSI3OLC
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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71587492
Created by
admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
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PRIMARY | |||
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137414-35-8
Created by
admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
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PRIMARY | |||
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058DSI3OLC
Created by
admin on Fri Dec 15 15:47:18 UTC 2023 , Edited by admin on Fri Dec 15 15:47:18 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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