Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C32H39N9O3.C7H8O3S |
| Molecular Weight | 769.912 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.C[C@@H](CC3(C2=NN=NN2)C4=CC=C(C=C4CCC5=CC(=CC=C35)C(=O)N(C)C)C(=O)N(C)C)NCC(=O)N6CCC[C@H]6C#N
InChI
InChIKey=BULNWZLJRCOXPR-VMZNWUEUSA-N
InChI=1S/C32H39N9O3.C7H8O3S/c1-20(34-19-28(42)41-14-6-7-25(41)18-33)17-32(31-35-37-38-36-31)26-12-10-23(29(43)39(2)3)15-21(26)8-9-22-16-24(11-13-27(22)32)30(44)40(4)5;1-6-2-4-7(5-3-6)11(8,9)10/h10-13,15-16,20,25,34H,6-9,14,17,19H2,1-5H3,(H,35,36,37,38);2-5H,1H3,(H,8,9,10)/t20-,25-;/m0./s1
| Molecular Formula | C7H8O3S |
| Molecular Weight | 172.202 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C32H39N9O3 |
| Molecular Weight | 597.7106 |
| Charge | 0 |
| 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
Sat Dec 16 10:26:15 GMT 2023
by
admin
on
Sat Dec 16 10:26:15 GMT 2023
|
| Record UNII |
2DI32P3XNE
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Code | English |
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91864518
Created by
admin on Sat Dec 16 10:26:15 GMT 2023 , Edited by admin on Sat Dec 16 10:26:15 GMT 2023
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2DI32P3XNE
Created by
admin on Sat Dec 16 10:26:15 GMT 2023 , Edited by admin on Sat Dec 16 10:26:15 GMT 2023
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1163719-08-1
Created by
admin on Sat Dec 16 10:26:15 GMT 2023 , Edited by admin on Sat Dec 16 10:26:15 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |