Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H22F6NO6S.Na |
| Molecular Weight | 625.512 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC(C)(C[C@H]1CN(C2=C(O1)C=CC(=C2)C3=CC(OC(F)F)=CC(F)=C3)S(=O)(=O)C4=CC(=CC=C4)C(F)(F)F)C([O-])=O
InChI
InChIKey=NWMACPZNQFABGF-BDQAORGHSA-M
InChI=1S/C27H23F6NO6S.Na/c1-26(2,24(35)36)13-20-14-34(41(37,38)21-5-3-4-17(11-21)27(31,32)33)22-10-15(6-7-23(22)39-20)16-8-18(28)12-19(9-16)40-25(29)30;/h3-12,20,25H,13-14H2,1-2H3,(H,35,36);/q;+1/p-1/t20-;/m0./s1
| Molecular Formula | C27H22F6NO6S |
| Molecular Weight | 602.522 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:00:39 GMT 2023
by
admin
on
Sat Dec 16 09:00:39 GMT 2023
|
| Record UNII |
T6S6P87405
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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2055538-47-9
Created by
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134694329
Created by
admin on Sat Dec 16 09:00:39 GMT 2023 , Edited by admin on Sat Dec 16 09:00:39 GMT 2023
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T6S6P87405
Created by
admin on Sat Dec 16 09:00:39 GMT 2023 , Edited by admin on Sat Dec 16 09:00:39 GMT 2023
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100000183620
Created by
admin on Sat Dec 16 09:00:39 GMT 2023 , Edited by admin on Sat Dec 16 09:00:39 GMT 2023
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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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