Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C36H39N4O4S.Na |
| Molecular Weight | 646.774 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].COC1=CN=C(N=C1)C2=CC=C(CN3C(CC(C)(C)C([O-])=O)=C(SC(C)(C)C)C4=C3C=CC(OCC5=NC=C(C)C=C5)=C4)C=C2
InChI
InChIKey=UFKVTMVFNCOIKU-UHFFFAOYSA-M
InChI=1S/C36H40N4O4S.Na/c1-23-8-13-26(37-18-23)22-44-27-14-15-30-29(16-27)32(45-35(2,3)4)31(17-36(5,6)34(41)42)40(30)21-24-9-11-25(12-10-24)33-38-19-28(43-7)20-39-33;/h8-16,18-20H,17,21-22H2,1-7H3,(H,41,42);/q;+1/p-1
| Molecular Formula | C36H39N4O4S |
| Molecular Weight | 623.784 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| 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
Mon Mar 31 21:27:52 GMT 2025
by
admin
on
Mon Mar 31 21:27:52 GMT 2025
|
| Record UNII |
8H678Y8F50
|
| Record Status |
Validated (UNII)
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| Record Version |
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46843035
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1233114-34-5
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8H678Y8F50
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admin on Mon Mar 31 21:27:52 GMT 2025 , Edited by admin on Mon Mar 31 21:27:52 GMT 2025
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