Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H17NO4.ClH |
| Molecular Weight | 275.729 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=C(OC)C=C(C[C@](C)(N)C(O)=O)C=C1
InChI
InChIKey=MBKUFCLQPYLOCC-YDALLXLXSA-N
InChI=1S/C12H17NO4.ClH/c1-12(13,11(14)15)7-8-4-5-9(16-2)10(6-8)17-3;/h4-6H,7,13H2,1-3H3,(H,14,15);1H/t12-;/m0./s1
| Molecular Formula | C12H17NO4 |
| Molecular Weight | 239.2677 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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
Sat Dec 16 10:38:09 UTC 2023
by
admin
on
Sat Dec 16 10:38:09 UTC 2023
|
| Record UNII |
E2YYD347EH
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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E2YYD347EH
Created by
admin on Sat Dec 16 10:38:09 UTC 2023 , Edited by admin on Sat Dec 16 10:38:09 UTC 2023
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DTXSID101019360
Created by
admin on Sat Dec 16 10:38:09 UTC 2023 , Edited by admin on Sat Dec 16 10:38:09 UTC 2023
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25102586
Created by
admin on Sat Dec 16 10:38:09 UTC 2023 , Edited by admin on Sat Dec 16 10:38:09 UTC 2023
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5486-79-3
Created by
admin on Sat Dec 16 10:38:09 UTC 2023 , Edited by admin on Sat Dec 16 10:38:09 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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