Details
| Stereochemistry | RACEMIC |
| Molecular Formula | 2C13H21NO3.C4H6O4 |
| Molecular Weight | 596.7095 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CCC(O)=O.CC(C)(C)NCC(O)C1=CC(CO)=C(O)C=C1.CC(C)(C)NCC(O)C2=CC(CO)=C(O)C=C2
InChI
InChIKey=XXUMOMICYCJWON-UHFFFAOYSA-N
InChI=1S/2C13H21NO3.C4H6O4/c2*1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15;5-3(6)1-2-4(7)8/h2*4-6,12,14-17H,7-8H2,1-3H3;1-2H2,(H,5,6)(H,7,8)
| Molecular Formula | C4H6O4 |
| Molecular Weight | 118.088 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C13H21NO3 |
| Molecular Weight | 239.3107 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:12:25 UTC 2023
by
admin
on
Sat Dec 16 19:12:25 UTC 2023
|
| Record UNII |
7PN7EB8BSQ
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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331284-85-6
Created by
admin on Sat Dec 16 19:12:26 UTC 2023 , Edited by admin on Sat Dec 16 19:12:26 UTC 2023
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7PN7EB8BSQ
Created by
admin on Sat Dec 16 19:12:26 UTC 2023 , Edited by admin on Sat Dec 16 19:12:26 UTC 2023
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164512898
Created by
admin on Sat Dec 16 19:12:26 UTC 2023 , Edited by admin on Sat Dec 16 19:12:26 UTC 2023
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PRIMARY |
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |
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