Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C44H60N6O17.Al.F |
| Molecular Weight | 989.9597 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[18F-].[Al+3].OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)CCC1=CC(CN(CCN(CC([O-])=O)CC2=C(O)C=CC(CCC(O)=O)=C2)CC([O-])=O)=C(O)C=C1)C(O)=O)C(O)=O
InChI
InChIKey=XIWCYNLURQSGJS-OECGVUFTSA-K
InChI=1S/C44H62N6O17.Al.FH/c51-34-13-8-28(22-30(34)24-49(26-40(59)60)20-21-50(27-41(61)62)25-31-23-29(9-14-35(31)52)11-16-38(55)56)10-15-37(54)46-18-4-1-2-7-36(53)45-19-5-3-6-32(42(63)64)47-44(67)48-33(43(65)66)12-17-39(57)58;;/h8-9,13-14,22-23,32-33,51-52H,1-7,10-12,15-21,24-27H2,(H,45,53)(H,46,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,63,64)(H,65,66)(H2,47,48,67);;1H/q;+3;/p-3/t32-,33-;;/m0../s1/i;;1-1
| Molecular Formula | FH |
| Molecular Weight | 19.00888 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | Al |
| Molecular Weight | 26.9815386 |
| Charge | 3 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C44H59N6O17 |
| Molecular Weight | 943.9693 |
| Charge | -3 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 01:07:06 GMT 2025
by
admin
on
Wed Apr 02 01:07:06 GMT 2025
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| Record UNII |
J1W7SQ7GC4
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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J1W7SQ7GC4
Created by
admin on Wed Apr 02 01:07:06 GMT 2025 , Edited by admin on Wed Apr 02 01:07:06 GMT 2025
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300000048027
Created by
admin on Wed Apr 02 01:07:06 GMT 2025 , Edited by admin on Wed Apr 02 01:07:06 GMT 2025
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139593469
Created by
admin on Wed Apr 02 01:07:06 GMT 2025 , Edited by admin on Wed Apr 02 01:07:06 GMT 2025
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| Related Record | Type | Details | ||
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NON-LABELED -> LABELED |
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TARGET->RADIOLIGAND |
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ACTIVE MOIETY |
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