Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H15F6N5O.C4H4O4 |
| Molecular Weight | 523.3858 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.N[C@@H](CC(=O)N1CCN2C(C1)=NN=C2C(F)(F)F)CC3=C(F)C=C(F)C(F)=C3
InChI
InChIKey=YRKLLQIZVVYDQY-OIJPFUDISA-N
InChI=1S/C16H15F6N5O.C4H4O4/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22;5-3(6)1-2-4(7)8/h4,6,9H,1-3,5,7,23H2;1-2H,(H,5,6)(H,7,8)/b;2-1+/t9-;/m1./s1
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C16H15F6N5O |
| Molecular Weight | 407.3136 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:09:07 UTC 2023
by
admin
on
Sat Dec 16 15:09:07 UTC 2023
|
| Record UNII |
85ZK84E34T
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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11386885
Created by
admin on Sat Dec 16 15:09:07 UTC 2023 , Edited by admin on Sat Dec 16 15:09:07 UTC 2023
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837430-24-7
Created by
admin on Sat Dec 16 15:09:07 UTC 2023 , Edited by admin on Sat Dec 16 15:09:07 UTC 2023
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PRIMARY | |||
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85ZK84E34T
Created by
admin on Sat Dec 16 15:09:07 UTC 2023 , Edited by admin on Sat Dec 16 15:09:07 UTC 2023
|
PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |
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