Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C32H48N4O4.Ga.I |
| Molecular Weight | 747.5804 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 2 |
| Charge | 0 |
| Stereo Comments | AXIAL, UNKNOWN |
SHOW SMILES / InChI
SMILES
[68Ga+3].[I-].CC(C)OC1=CC=CC(C=NCC(C)(C)CNCCNCC(C)(C)CN=CC2=CC=CC(OC(C)C)=C2[O-])=C1[O-]
InChI
InChIKey=FDGRAHASSGZIRO-LEDNNGLLSA-K
InChI=1S/C32H50N4O4.Ga.HI/c1-23(2)39-27-13-9-11-25(29(27)37)17-35-21-31(5,6)19-33-15-16-34-20-32(7,8)22-36-18-26-12-10-14-28(30(26)38)40-24(3)4;;/h9-14,17-18,23-24,33-34,37-38H,15-16,19-22H2,1-8H3;;1H/q;+3;/p-3/b35-17+,36-18+;;/i;1-2;
| Molecular Formula | C32H48N4O4 |
| Molecular Weight | 552.7479 |
| Charge | -2 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 2 |
| Optical Activity | NONE |
| Molecular Formula | I |
| Molecular Weight | 126.90447 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | Ga |
| Molecular Weight | 67.927983497 |
| Charge | 3 |
| 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
Wed Apr 02 11:18:42 GMT 2025
by
admin
on
Wed Apr 02 11:18:42 GMT 2025
|
| Record UNII |
4PJX596UYL
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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1393486-96-8
Created by
admin on Wed Apr 02 11:18:42 GMT 2025 , Edited by admin on Wed Apr 02 11:18:42 GMT 2025
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4PJX596UYL
Created by
admin on Wed Apr 02 11:18:42 GMT 2025 , Edited by admin on Wed Apr 02 11:18:42 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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