Details
Stereochemistry | RACEMIC |
Molecular Formula | C23H23FNO4.Na |
Molecular Weight | 419.4212 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CCN1C(\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)=C(C2=C1C=CC=C2)C3=CC=C(F)C=C3
InChI
InChIKey=KTBBQAQDAUENCT-HDPLEABFSA-M
InChI=1S/C23H24FNO4.Na/c1-2-25-20-6-4-3-5-19(20)23(15-7-9-16(24)10-8-15)21(25)12-11-17(26)13-18(27)14-22(28)29;/h3-12,17-18,26-27H,2,13-14H2,1H3,(H,28,29);/q;+1/p-1/b12-11+;/t17-,18-;/m1./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 | C23H23FNO4 |
Molecular Weight | 396.4314 |
Charge | -1 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:13:11 GMT 2023
by
admin
on
Sat Dec 16 05:13:11 GMT 2023
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Record UNII |
92B8U56717
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Record Status |
Validated (UNII)
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Record Version |
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-
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93936-64-2
Created by
admin on Sat Dec 16 05:13:11 GMT 2023 , Edited by admin on Sat Dec 16 05:13:11 GMT 2023
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92B8U56717
Created by
admin on Sat Dec 16 05:13:11 GMT 2023 , Edited by admin on Sat Dec 16 05:13:11 GMT 2023
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