Details
Stereochemistry | RACEMIC |
Molecular Formula | C28H38N2O6.ClH |
Molecular Weight | 535.072 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCOC(=O)C1=C(C)NC(CN(C)C)=C(C1C2=CC=CC=C2\C=C\C(=O)OC(C)(C)C)C(=O)OCC
InChI
InChIKey=VMZCXIGDNRMWGI-GEEYTBSJSA-N
InChI=1S/C28H38N2O6.ClH/c1-9-34-26(32)23-18(3)29-21(17-30(7)8)25(27(33)35-10-2)24(23)20-14-12-11-13-19(20)15-16-22(31)36-28(4,5)6;/h11-16,24,29H,9-10,17H2,1-8H3;1H/b16-15+;
Molecular Formula | C28H38N2O6 |
Molecular Weight | 498.6111 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 1 |
Optical Activity | ( + / - ) |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:32:36 UTC 2023
by
admin
on
Fri Dec 15 16:32:36 UTC 2023
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Record UNII |
7P6B96QLKN
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C333
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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Code System | Code | Type | Description | ||
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C66585
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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BB-35
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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PRIMARY | |||
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C091233
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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PRIMARY | |||
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108700-03-4
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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PRIMARY | |||
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7P6B96QLKN
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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PRIMARY | |||
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9893335
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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CHEMBL2110624
Created by
admin on Fri Dec 15 16:32:36 UTC 2023 , Edited by admin on Fri Dec 15 16:32:36 UTC 2023
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PRIMARY |
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ACTIVE MOIETY |