Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C31H45N9O4.3ClH |
Molecular Weight | 717.13 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.Cl.CC1=CC(O)=CC(C)=C1C[C@H](NC(=O)[C@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C2=NC(CC3=CC=CC=C3)=NO2
InChI
InChIKey=MGRJKQDIRXYQSS-BYWPFWNBSA-N
InChI=1S/C31H45N9O4.3ClH/c1-19-15-22(41)16-20(2)23(19)18-26(38-28(42)24(33)11-8-14-36-31(34)35)29(43)37-25(12-6-7-13-32)30-39-27(40-44-30)17-21-9-4-3-5-10-21;;;/h3-5,9-10,15-16,24-26,41H,6-8,11-14,17-18,32-33H2,1-2H3,(H,37,43)(H,38,42)(H4,34,35,36);3*1H/t24-,25+,26+;;;/m1.../s1
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C31H45N9O4 |
Molecular Weight | 607.7469 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:22:45 GMT 2023
by
admin
on
Sat Dec 16 19:22:45 GMT 2023
|
Record UNII |
66CG5Q6RLH
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Code | English | ||
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Systematic Name | English |
Classification Tree | Code System | Code | ||
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FDA ORPHAN DRUG |
902322
Created by
admin on Sat Dec 16 19:22:45 GMT 2023 , Edited by admin on Sat Dec 16 19:22:45 GMT 2023
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Code System | Code | Type | Description | ||
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2589640-11-7
Created by
admin on Sat Dec 16 19:22:45 GMT 2023 , Edited by admin on Sat Dec 16 19:22:45 GMT 2023
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PRIMARY | |||
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163361905
Created by
admin on Sat Dec 16 19:22:45 GMT 2023 , Edited by admin on Sat Dec 16 19:22:45 GMT 2023
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PRIMARY | |||
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66CG5Q6RLH
Created by
admin on Sat Dec 16 19:22:45 GMT 2023 , Edited by admin on Sat Dec 16 19:22:45 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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