Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H27N3O5S |
Molecular Weight | 433.521 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2N3C(=O)[C@H](NC3(C)C)C4=CC=CC=C4)C(=O)OCOC
InChI
InChIKey=QTQPGZVDUCMVLK-ZXFNITATSA-N
InChI=1S/C21H27N3O5S/c1-20(2)15(19(27)29-11-28-5)23-17(26)14(18(23)30-20)24-16(25)13(22-21(24,3)4)12-9-7-6-8-10-12/h6-10,13-15,18,22H,11H2,1-5H3/t13-,14-,15+,18-/m1/s1
Molecular Formula | C21H27N3O5S |
Molecular Weight | 433.521 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:32:26 UTC 2023
by
admin
on
Fri Dec 15 16:32:26 UTC 2023
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Record UNII |
O70J1GE4YB
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Record Status |
Validated (UNII)
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Record Version |
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-
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Official Name | English | ||
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Code | English | ||
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Systematic Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1500
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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Code System | Code | Type | Description | ||
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4053
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SUB10454MIG
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admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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C90914
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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CHEMBL2105404
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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60252-40-6
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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100000084078
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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76970981
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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40966-79-8
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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ALTERNATIVE | |||
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O70J1GE4YB
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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DTXSID401023455
Created by
admin on Fri Dec 15 16:32:26 UTC 2023 , Edited by admin on Fri Dec 15 16:32:26 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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METABOLITE -> PARENT | |||
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METABOLITE ACTIVE -> PRODRUG |