Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C32H29F5N3O5.Na |
Molecular Weight | 653.5715 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].COC1=CC=CC(=C1F)C2=C(C)N(CC3=C(C=CC=C3F)C(F)(F)F)C(=O)N(C[C@H](NCCCC([O-])=O)C4=CC=CC=C4)C2=O
InChI
InChIKey=DQYGXRQUFSRDCH-UQIIZPHYSA-M
InChI=1S/C32H30F5N3O5.Na/c1-19-28(21-11-6-14-26(45-2)29(21)34)30(43)40(18-25(20-9-4-3-5-10-20)38-16-8-15-27(41)42)31(44)39(19)17-22-23(32(35,36)37)12-7-13-24(22)33;/h3-7,9-14,25,38H,8,15-18H2,1-2H3,(H,41,42);/q;+1/p-1/t25-;/m0./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 | C32H29F5N3O5 |
Molecular Weight | 630.5818 |
Charge | -1 |
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
Fri Dec 15 16:31:27 UTC 2023
by
admin
on
Fri Dec 15 16:31:27 UTC 2023
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Record UNII |
5948VUI423
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Record Status |
Validated (UNII)
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Record Version |
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-
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100000174591
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24785956
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832720-36-2
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5948VUI423
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2049847
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C166831
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DBSALT002117
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m4850
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admin on Fri Dec 15 16:31:27 UTC 2023 , Edited by admin on Fri Dec 15 16:31:27 UTC 2023
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PRIMARY | Merck Index | ||
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CHEMBL1208155
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admin on Fri Dec 15 16:31:27 UTC 2023 , Edited by admin on Fri Dec 15 16:31:27 UTC 2023
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TT-68
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DTXSID601003247
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5948VUI423
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admin on Fri Dec 15 16:31:27 UTC 2023 , Edited by admin on Fri Dec 15 16:31:27 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |