Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H15N.C4H4O4 |
Molecular Weight | 337.3692 |
Optical Activity | ( + ) |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.C[C@]12N[C@H](CC3=C1C=CC=C3)C4=CC=CC=C24
InChI
InChIKey=QLTXKCWMEZIHBJ-PJGJYSAQSA-N
InChI=1S/C16H15N.C4H4O4/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16;5-3(6)1-2-4(7)8/h2-9,15,17H,10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-,16+;/m1./s1
Molecular Formula | C16H15N |
Molecular Weight | 221.297 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:12:19 UTC 2023
by
admin
on
Fri Dec 15 17:12:19 UTC 2023
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Record UNII |
6LR8C1B66Q
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Record Status |
Validated (UNII)
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Record Version |
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-
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Code System | Code | Type | Description | ||
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278-614-5
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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DTXSID2045785
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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6LR8C1B66Q
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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6420042
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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Z-36
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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CHEMBL284237
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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D016291
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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m4700
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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PRIMARY | Merck Index | ||
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C166949
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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77086-22-7
Created by
admin on Fri Dec 15 17:12:19 UTC 2023 , Edited by admin on Fri Dec 15 17:12:19 UTC 2023
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PRIMARY |
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ACTIVE MOIETY |
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