Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H31NO4S |
| Molecular Weight | 417.562 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCC[C@]1(CC)CS(=O)(=O)C2=CC(OC)=C(OC)C=C2[C@H](N1)C3=CC=CC=C3
InChI
InChIKey=CKFWDLFFXXVSBJ-DHIUTWEWSA-N
InChI=1S/C23H31NO4S/c1-5-7-13-23(6-2)16-29(25,26)21-15-20(28-4)19(27-3)14-18(21)22(24-23)17-11-9-8-10-12-17/h8-12,14-15,22,24H,5-7,13,16H2,1-4H3/t22-,23-/m1/s1
| Molecular Formula | C23H31NO4S |
| Molecular Weight | 417.562 |
| 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 14:24:27 UTC 2023
by
admin
on
Sat Dec 16 14:24:27 UTC 2023
|
| Record UNII |
8GYW8T88JI
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Code | English | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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178961-24-5
Created by
admin on Sat Dec 16 14:24:27 UTC 2023 , Edited by admin on Sat Dec 16 14:24:27 UTC 2023
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NON-SPECIFIC STEREOCHEMISTRY | |||
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8GYW8T88JI
Created by
admin on Sat Dec 16 14:24:27 UTC 2023 , Edited by admin on Sat Dec 16 14:24:27 UTC 2023
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PRIMARY | |||
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178259-25-1
Created by
admin on Sat Dec 16 14:24:27 UTC 2023 , Edited by admin on Sat Dec 16 14:24:27 UTC 2023
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PRIMARY | |||
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9823277
Created by
admin on Sat Dec 16 14:24:27 UTC 2023 , Edited by admin on Sat Dec 16 14:24:27 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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METABOLIC ENZYME -> INDUCER |
MODERATE
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TARGET -> INHIBITOR |
Ki
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
