Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C27H38N2O4 |
Molecular Weight | 454.6016 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(OC)C=C(CCN(C)CCC[C@@](C#N)(C(C)C)C2=CC(OC)=C(OC)C=C2)C=C1
InChI
InChIKey=SGTNSNPWRIOYBX-HHHXNRCGSA-N
InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3/t27-/m1/s1
Molecular Formula | C27H38N2O4 |
Molecular Weight | 454.6016 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:22:50 UTC 2023
by
admin
on
Sat Dec 16 16:22:50 UTC 2023
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Record UNII |
QR5PYD126V
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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 Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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Code System | Code | Type | Description | ||
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DTXSID501009404
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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SUB07056MIG
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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QR5PYD126V
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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253-878-4
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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77734
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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CHEMBL197
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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100000082900
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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C1563
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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m11414
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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PRIMARY | Merck Index | ||
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65808
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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DB14063
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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6813
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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38321-02-7
Created by
admin on Sat Dec 16 16:22:50 UTC 2023 , Edited by admin on Sat Dec 16 16:22:50 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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TRANSPORTER -> INHIBITOR |
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SALT/SOLVATE -> PARENT |
Related Record | Type | Details | ||
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ACTIVE MOIETY |