Details
| Stereochemistry | MIXED |
| Molecular Formula | 2C19H15O4.C3H8O.2Na |
| Molecular Weight | 720.7146 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].CC(C)O.CC(=O)CC(C1=CC=CC=C1)C2=C([O-])C3=CC=CC=C3OC2=O.CC(=O)CC(C4=CC=CC=C4)C5=C([O-])C6=CC=CC=C6OC5=O
InChI
InChIKey=VLYIGFRRLKDPQS-UHFFFAOYSA-L
InChI=1S/2C19H16O4.C3H8O.2Na/c2*1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;1-3(2)4;;/h2*2-10,15,21H,11H2,1H3;3-4H,1-2H3;;/q;;;2*+1/p-2
| Molecular Formula | C19H15O4 |
| Molecular Weight | 307.32 |
| Charge | -1 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| Molecular Formula | Na |
| Molecular Weight | 22.9898 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C3H8O |
| Molecular Weight | 60.095 |
| 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 14:59:39 UTC 2023
by
admin
on
Fri Dec 15 14:59:39 UTC 2023
|
| Record UNII |
4V2UBU7H8W
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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4V2UBU7H8W
Created by
admin on Fri Dec 15 14:59:39 UTC 2023 , Edited by admin on Fri Dec 15 14:59:39 UTC 2023
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PRIMARY | |||
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145996738
Created by
admin on Fri Dec 15 14:59:39 UTC 2023 , Edited by admin on Fri Dec 15 14:59:39 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |