Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C20H17N2O5.Na |
Molecular Weight | 388.3491 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC[C@@](O)(C([O-])=O)C1=C(CO)C(=O)N2CC3=CC4=C(C=CC=C4)N=C3C2=C1
InChI
InChIKey=HPSUBMDJBRNXKK-BDQAORGHSA-M
InChI=1S/C20H18N2O5.Na/c1-2-20(27,19(25)26)14-8-16-17-12(9-22(16)18(24)13(14)10-23)7-11-5-3-4-6-15(11)21-17;/h3-8,23,27H,2,9-10H2,1H3,(H,25,26);/q;+1/p-1/t20-;/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 | C20H17N2O5 |
Molecular Weight | 365.3594 |
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 15:19:52 GMT 2023
by
admin
on
Fri Dec 15 15:19:52 GMT 2023
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Record UNII |
3L6CT9UWOM
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1904
Created by
admin on Fri Dec 15 15:19:53 GMT 2023 , Edited by admin on Fri Dec 15 15:19:53 GMT 2023
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Code System | Code | Type | Description | ||
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C2344
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admin on Fri Dec 15 15:19:53 GMT 2023 , Edited by admin on Fri Dec 15 15:19:53 GMT 2023
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PRIMARY | |||
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3L6CT9UWOM
Created by
admin on Fri Dec 15 15:19:53 GMT 2023 , Edited by admin on Fri Dec 15 15:19:53 GMT 2023
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PRIMARY | |||
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23705698
Created by
admin on Fri Dec 15 15:19:53 GMT 2023 , Edited by admin on Fri Dec 15 15:19:53 GMT 2023
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25387-67-1
Created by
admin on Fri Dec 15 15:19:53 GMT 2023 , Edited by admin on Fri Dec 15 15:19:53 GMT 2023
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100880
Created by
admin on Fri Dec 15 15:19:53 GMT 2023 , Edited by admin on Fri Dec 15 15:19:53 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |