Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C12H16O4 |
| Molecular Weight | 224.253 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCC\C=C1/OC(=O)C2=C1CC[C@@H](O)[C@H]2O
InChI
InChIKey=DQNGMIQSXNGHOA-OBEBJBLMSA-N
InChI=1S/C12H16O4/c1-2-3-4-9-7-5-6-8(13)11(14)10(7)12(15)16-9/h4,8,11,13-14H,2-3,5-6H2,1H3/b9-4-/t8-,11-/m1/s1
| Molecular Formula | C12H16O4 |
| Molecular Weight | 224.253 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 13:38:21 GMT 2025
by
admin
on
Wed Apr 02 13:38:21 GMT 2025
|
| Record UNII |
56W6M8HQ2G
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
Download
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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56W6M8HQ2G
Created by
admin on Wed Apr 02 13:38:21 GMT 2025 , Edited by admin on Wed Apr 02 13:38:21 GMT 2025
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94596-27-7
Created by
admin on Wed Apr 02 13:38:21 GMT 2025 , Edited by admin on Wed Apr 02 13:38:21 GMT 2025
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13965088
Created by
admin on Wed Apr 02 13:38:21 GMT 2025 , Edited by admin on Wed Apr 02 13:38:21 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE ACTIVE |
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