Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C18H25N3O.H3O4P |
| Molecular Weight | 397.4058 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OP(O)(O)=O.CC1=NC(NCCCCCCC2=CC=CC=C2)=NC(C)=C1O
InChI
InChIKey=BPQAYMFGBGMJRY-UHFFFAOYSA-N
InChI=1S/C18H25N3O.H3O4P/c1-14-17(22)15(2)21-18(20-14)19-13-9-4-3-6-10-16-11-7-5-8-12-16;1-5(2,3)4/h5,7-8,11-12,22H,3-4,6,9-10,13H2,1-2H3,(H,19,20,21);(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 | C18H25N3O |
| Molecular Weight | 299.4106 |
| 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
Mon Mar 31 17:58:33 GMT 2025
by
admin
on
Mon Mar 31 17:58:33 GMT 2025
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| Record UNII |
93VML10KA9
|
| Record Status |
Validated (UNII)
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| Record Version |
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Download
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Preferred Name | English | ||
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Official Name | English | ||
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Common Name | English | ||
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Code | English | ||
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Systematic Name | English | ||
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Code | English | ||
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Systematic Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C1322
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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NCI_THESAURUS |
C29708
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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CHEMBL85959
Created by
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PRIMARY | |||
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300000055462
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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PRIMARY | |||
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C74276
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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132956-22-0
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admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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PRIMARY | |||
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DTXSID90927878
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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PRIMARY | |||
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9930677
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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PRIMARY | |||
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93VML10KA9
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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PRIMARY | |||
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DD-71
Created by
admin on Mon Mar 31 17:58:33 GMT 2025 , Edited by admin on Mon Mar 31 17:58:33 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |