Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C19H28NO3.C7H8O3S.H2O |
| Molecular Weight | 508.647 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 0 |
| Charge | 1 |
SHOW SMILES / InChI
SMILES
O.CC1=CC=C(C=C1)S(O)(=O)=O.C[N+]2(C)CC[C@H](C2)OC(=O)[C@@](O)(C3CCCC3)C4=CC=CC=C4
InChI
InChIKey=UOWOLENSDISMPG-QFZUCXBQSA-N
InChI=1S/C19H28NO3.C7H8O3S.H2O/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15;1-6-2-4-7(5-3-6)11(8,9)10;/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3;2-5H,1H3,(H,8,9,10);1H2/q+1;;/t17-,19+;;/m1../s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
X2N5209428
Created by
admin on Tue Apr 01 16:39:22 GMT 2025 , Edited by admin on Tue Apr 01 16:39:22 GMT 2025
|
PRIMARY | |||
|
121491323
Created by
admin on Tue Apr 01 16:39:22 GMT 2025 , Edited by admin on Tue Apr 01 16:39:22 GMT 2025
|
PRIMARY |
PARENT (SALT/SOLVATE)
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
