Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C12H16F3N.C10H16O4 |
Molecular Weight | 431.489 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1(C)[C@H](CC[C@@]1(C)C(O)=O)C(O)=O.CCN[C@@H](C)CC2=CC(=CC=C2)C(F)(F)F
InChI
InChIKey=GBMYZGXLAHAFPC-JGTDEUSISA-N
InChI=1S/C12H16F3N.C10H16O4/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15;1-9(2)6(7(11)12)4-5-10(9,3)8(13)14/h4-6,8-9,16H,3,7H2,1-2H3;6H,4-5H2,1-3H3,(H,11,12)(H,13,14)/t9-;6-,10+/m01/s1
Molecular Formula | C12H16F3N |
Molecular Weight | 231.2573 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C10H16O4 |
Molecular Weight | 200.2316 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:57:08 UTC 2023
by
admin
on
Sat Dec 16 11:57:08 UTC 2023
|
Record UNII |
A5F7LF38KW
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Common Name | English | ||
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Common Name | English |
Code System | Code | Type | Description | ||
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306-384-9
Created by
admin on Sat Dec 16 11:57:08 UTC 2023 , Edited by admin on Sat Dec 16 11:57:08 UTC 2023
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PRIMARY | |||
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97158-54-8
Created by
admin on Sat Dec 16 11:57:08 UTC 2023 , Edited by admin on Sat Dec 16 11:57:08 UTC 2023
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NON-SPECIFIC STEREOCHEMISTRY | |||
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DTXSID40242740
Created by
admin on Sat Dec 16 11:57:08 UTC 2023 , Edited by admin on Sat Dec 16 11:57:08 UTC 2023
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PRIMARY | |||
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44152151
Created by
admin on Sat Dec 16 11:57:08 UTC 2023 , Edited by admin on Sat Dec 16 11:57:08 UTC 2023
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PRIMARY | |||
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A5F7LF38KW
Created by
admin on Sat Dec 16 11:57:08 UTC 2023 , Edited by admin on Sat Dec 16 11:57:08 UTC 2023
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PRIMARY | |||
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17325-68-7
Created by
admin on Sat Dec 16 11:57:08 UTC 2023 , Edited by admin on Sat Dec 16 11:57:08 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |