Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C22H28N2O2.H3O4P |
| Molecular Weight | 450.4651 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OP(O)(O)=O.CCOC(=O)C1(CCN(CCC2=CC=C(N)C=C2)CC1)C3=CC=CC=C3
InChI
InChIKey=FLQCEKVTYABVSH-UHFFFAOYSA-N
InChI=1S/C22H28N2O2.H3O4P/c1-2-26-21(25)22(19-6-4-3-5-7-19)13-16-24(17-14-22)15-12-18-8-10-20(23)11-9-18;1-5(2,3)4/h3-11H,2,12-17,23H2,1H3;(H3,1,2,3,4)
| Molecular Formula | H3O4P |
| Molecular Weight | 97.9952 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C22H28N2O2 |
| Molecular Weight | 352.4699 |
| 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
Sat Dec 16 04:48:03 UTC 2023
by
admin
on
Sat Dec 16 04:48:03 UTC 2023
|
| Record UNII |
3584484N8V
|
| 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 |
C241
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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NCI_THESAURUS |
C1506
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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1976-75-6
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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100000085183
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PRIMARY | |||
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DTXSID801027378
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4268-37-5
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admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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3584484N8V
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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CHEMBL1201347
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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PRIMARY | |||
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C87352
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admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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DBSALT001390
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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PRIMARY | |||
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C100232
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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PRIMARY | |||
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16051989
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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SUB00533MIG
Created by
admin on Sat Dec 16 04:48:03 UTC 2023 , Edited by admin on Sat Dec 16 04:48:03 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |