Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C74H95ClN19O21S2.Lu |
Molecular Weight | 1863.188 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[177Lu+3].[H][C@]1(NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC2=CC=C(NC(N)=O)C=C2)NC(=O)[C@H](CC3=CC=C(NC(=O)[C@@H]4CC(=O)NC(=O)N4)C=C3)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@H](CC5=CC=C(O)C=C5)C(N)=O)NC(=O)[C@H](CC6=CC=C(Cl)C=C6)NC(=O)CN7CCN(CC([O-])=O)CCN(CC([O-])=O)CCN(CC([O-])=O)CC7)[C@@H](C)O
InChI
InChIKey=LGPOVIJRCHASEQ-TWMOUGLCSA-K
InChI=1S/C74H98ClN19O21S2.Lu/c1-41(95)63-72(113)87-57(70(111)83-51(64(77)105)30-45-11-19-49(96)20-12-45)40-117-116-39-56(86-67(108)52(31-42-5-13-46(75)14-6-42)81-59(98)35-91-22-24-92(36-60(99)100)26-28-94(38-62(103)104)29-27-93(25-23-91)37-61(101)102)71(112)85-54(33-43-7-15-47(16-8-43)79-66(107)55-34-58(97)89-74(115)88-55)69(110)84-53(32-44-9-17-48(18-10-44)80-73(78)114)68(109)82-50(65(106)90-63)4-2-3-21-76;/h5-20,41,50-57,63,95-96H,2-4,21-40,76H2,1H3,(H2,77,105)(H,79,107)(H,81,98)(H,82,109)(H,83,111)(H,84,110)(H,85,112)(H,86,108)(H,87,113)(H,90,106)(H,99,100)(H,101,102)(H,103,104)(H3,78,80,114)(H2,88,89,97,115);/q;+3/p-3/t41-,50+,51-,52+,53-,54+,55+,56-,57+,63+;/m1./s1/i;1+2
Molecular Formula | C74H95ClN19O21S2 |
Molecular Weight | 1686.244 |
Charge | -3 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 5 |
Optical Activity | UNSPECIFIED |
Molecular Formula | Lu |
Molecular Weight | 176.9438 |
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
Sat Dec 16 13:58:32 GMT 2023
by
admin
on
Sat Dec 16 13:58:32 GMT 2023
|
Record UNII |
CAX3X53UL6
|
Record Status |
Validated (UNII)
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Record Version |
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-
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CAX3X53UL6
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admin on Sat Dec 16 13:58:32 GMT 2023 , Edited by admin on Sat Dec 16 13:58:32 GMT 2023
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1934243-21-6
Created by
admin on Sat Dec 16 13:58:32 GMT 2023 , Edited by admin on Sat Dec 16 13:58:32 GMT 2023
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137528274
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admin on Sat Dec 16 13:58:32 GMT 2023 , Edited by admin on Sat Dec 16 13:58:32 GMT 2023
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2211152-69-9
Created by
admin on Sat Dec 16 13:58:32 GMT 2023 , Edited by admin on Sat Dec 16 13:58:32 GMT 2023
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SUB195083
Created by
admin on Sat Dec 16 13:58:32 GMT 2023 , Edited by admin on Sat Dec 16 13:58:32 GMT 2023
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100000181427
Created by
admin on Sat Dec 16 13:58:32 GMT 2023 , Edited by admin on Sat Dec 16 13:58:32 GMT 2023
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C124929
Created by
admin on Sat Dec 16 13:58:32 GMT 2023 , Edited by admin on Sat Dec 16 13:58:32 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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TARGET->RADIOLIGAND |
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NON-LABELED -> LABELED |
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