Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C14H13O3.Na |
Molecular Weight | 252.241 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].COC1=CC2=CC=C(C=C2C=C1)[C@H](C)C([O-])=O
InChI
InChIKey=CDBRNDSHEYLDJV-FVGYRXGTSA-M
InChI=1S/C14H14O3.Na/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;/h3-9H,1-2H3,(H,15,16);/q;+1/p-1/t9-;/m0./s1
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 | C14H13O3 |
Molecular Weight | 229.2512 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:20:18 UTC 2023
by
admin
on
Fri Dec 15 15:20:18 UTC 2023
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Record UNII |
9TN87S3A3C
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1323
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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Code System | Code | Type | Description | ||
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142442
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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PRIMARY | RxNorm | ||
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m7769
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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PRIMARY | Merck Index | ||
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247-486-2
Created by
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PRIMARY | |||
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SUB166156
Created by
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PRIMARY | |||
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C48006
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PRIMARY | |||
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SUB03392MIG
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DBSALT000949
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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1457403
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26159-34-2
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23681059
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CHEMBL154
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100000092256
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9TN87S3A3C
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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DTXSID7045576
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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9TN87S3A3C
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
BASIS OF STRENGTH->SUBSTANCE |
ASSAY (TITRATION)
USP
|
||
|
PARENT -> SALT/SOLVATE | |||
|
BASIS OF STRENGTH->SUBSTANCE |
ASSAY (TITRATION)
EP
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
||
|
IMPURITY -> PARENT |
UNSPECIFIED
EP
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
ACTIVE MOIETY |