Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C27H29ClN6O5 |
Molecular Weight | 553.009 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCCC1=NC(Cl)=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4)C(=O)O[C@H](C)OC(=O)OCC
InChI
InChIKey=IDAWWPOAHPVPMY-KRWDZBQOSA-N
InChI=1S/C27H29ClN6O5/c1-4-6-11-22-29-24(28)23(26(35)38-17(3)39-27(36)37-5-2)34(22)16-18-12-14-19(15-13-18)20-9-7-8-10-21(20)25-30-32-33-31-25/h7-10,12-15,17H,4-6,11,16H2,1-3H3,(H,30,31,32,33)/t17-/m0/s1
Molecular Formula | C27H29ClN6O5 |
Molecular Weight | 553.009 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:40:28 GMT 2023
by
admin
on
Sat Dec 16 10:40:28 GMT 2023
|
Record UNII |
0S1JVU714D
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Record Status |
Validated (UNII)
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Record Version |
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-
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0S1JVU714D
Created by
admin on Sat Dec 16 10:40:29 GMT 2023 , Edited by admin on Sat Dec 16 10:40:29 GMT 2023
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92211280
Created by
admin on Sat Dec 16 10:40:29 GMT 2023 , Edited by admin on Sat Dec 16 10:40:29 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |