Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C21H27NO2.C6H8O7 |
| Molecular Weight | 843.0127 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CCC(=O)O[C@@](CC1=CC=CC=C1)([C@H](C)CNC)C2=CC=CC=C2.CCC(=O)O[C@@](CC3=CC=CC=C3)([C@H](C)CNC)C4=CC=CC=C4
InChI
InChIKey=SGTBCLTVPLYTRI-OXXXZDCLSA-N
InChI=1S/2C21H27NO2.C6H8O7/c2*1-4-20(23)24-21(17(2)16-22-3,19-13-9-6-10-14-19)15-18-11-7-5-8-12-18;7-3(8)1-6(13,5(11)12)2-4(9)10/h2*5-14,17,22H,4,15-16H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t2*17-,21+;/m11./s1
| 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 |
| Molecular Formula | C21H27NO2 |
| Molecular Weight | 325.4446 |
| 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
Mon Mar 31 17:54:33 GMT 2025
by
admin
on
Mon Mar 31 17:54:33 GMT 2025
|
| Record UNII |
ZWC8MXE10D
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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ZWC8MXE10D
Created by
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68300-80-1
Created by
admin on Mon Mar 31 17:54:33 GMT 2025 , Edited by admin on Mon Mar 31 17:54:33 GMT 2025
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71587236
Created by
admin on Mon Mar 31 17:54:33 GMT 2025 , Edited by admin on Mon Mar 31 17:54:33 GMT 2025
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DTXSID30218459
Created by
admin on Mon Mar 31 17:54:33 GMT 2025 , Edited by admin on Mon Mar 31 17:54:33 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
