Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H22N4O.C4H4O4 |
| Molecular Weight | 402.4442 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 3 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.CN1CCCC1=NC(=NC2=CC=CC=C2)N3CCOCC3
InChI
InChIKey=ZSAMTXUUUFXIII-WLHGVMLRSA-N
InChI=1S/C16H22N4O.C4H4O4/c1-19-9-5-8-15(19)18-16(20-10-12-21-13-11-20)17-14-6-3-2-4-7-14;5-3(6)1-2-4(7)8/h2-4,6-7H,5,8-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Code | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C29711
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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C044425
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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PRIMARY | |||
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78782-47-5
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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PRIMARY | |||
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T-15
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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PRIMARY | |||
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C87619
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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PRIMARY | |||
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66630041
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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PRIMARY | |||
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4326S15UIP
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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PRIMARY | |||
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CHEMBL40356
Created by
admin on Fri Dec 15 15:30:04 UTC 2023 , Edited by admin on Fri Dec 15 15:30:04 UTC 2023
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PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
