Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C17H31O3.Na.2H2O |
| Molecular Weight | 342.4466 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.[Na+].CCCCCCCCCCCCCCC1(CO1)C([O-])=O
InChI
InChIKey=KFSQDUBDCZTCRP-UHFFFAOYSA-M
InChI=1S/C17H32O3.Na.2H2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(15-20-17)16(18)19;;;/h2-15H2,1H3,(H,18,19);;2*1H2/q;+1;;/p-1
| Molecular Formula | C17H32O3 |
| Molecular Weight | 284.4342 |
| Charge | 0 |
| 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 | 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
Fri Dec 15 16:29:12 UTC 2023
by
admin
on
Fri Dec 15 16:29:12 UTC 2023
|
| Record UNII |
P5P95SB639
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Code | English | ||
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Common Name | English | ||
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Common Name | English | ||
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Systematic Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
|
NCI_THESAURUS |
C29711
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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23685788
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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PRIMARY | |||
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CHEMBL12394
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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PRIMARY | |||
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P5P95SB639
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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PRIMARY | |||
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T-17
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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PRIMARY | |||
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79069-97-9
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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PRIMARY | |||
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C66295
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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PRIMARY | |||
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DTXSID301000244
Created by
admin on Fri Dec 15 16:29:12 UTC 2023 , Edited by admin on Fri Dec 15 16:29:12 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
PARENT -> SALT/SOLVATE | |||
|
ANHYDROUS->SOLVATE |
