Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H23NO5.C4H6O6.H2O |
| Molecular Weight | 525.5024 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O[C@H]([C@@H](O)C(O)=O)C(O)=O.COC1=CC2=C(C(OC)=C1OC)C3=CC=C(OC)C(=O)C=C3[C@@H](N)CC2
InChI
InChIKey=OBMKOHRHLIBDCR-NASHDYMQSA-N
InChI=1S/C20H23NO5.C4H6O6.H2O/c1-23-16-8-6-12-13(10-15(16)22)14(21)7-5-11-9-17(24-2)19(25-3)20(26-4)18(11)12;5-1(3(7)8)2(6)4(9)10;/h6,8-10,14H,5,7,21H2,1-4H3;1-2,5-6H,(H,7,8)(H,9,10);1H2/t14-;1-,2-;/m01./s1
| Molecular Formula | C4H6O6 |
| Molecular Weight | 150.0868 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C20H23NO5 |
| Molecular Weight | 357.4003 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| 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
Mon Mar 31 17:55:37 GMT 2025
by
admin
on
Mon Mar 31 17:55:37 GMT 2025
|
| Record UNII |
1MSQ9O0VPM
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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23255-02-9
Created by
admin on Mon Mar 31 17:55:37 GMT 2025 , Edited by admin on Mon Mar 31 17:55:37 GMT 2025
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PRIMARY | |||
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1MSQ9O0VPM
Created by
admin on Mon Mar 31 17:55:37 GMT 2025 , Edited by admin on Mon Mar 31 17:55:37 GMT 2025
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PRIMARY | |||
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123133511
Created by
admin on Mon Mar 31 17:55:37 GMT 2025 , Edited by admin on Mon Mar 31 17:55:37 GMT 2025
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PRIMARY | |||
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566519
Created by
admin on Mon Mar 31 17:55:37 GMT 2025 , Edited by admin on Mon Mar 31 17:55:37 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
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|
PARENT -> SALT/SOLVATE |