Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C13H16N2.H3O4P |
| Molecular Weight | 298.2747 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OP(O)(O)=O.C1CN=C(N1)C2CCCC3=CC=CC=C23
InChI
InChIKey=HPGQQPUQEIRXHP-UHFFFAOYSA-N
InChI=1S/C13H16N2.H3O4P/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13;1-5(2,3)4/h1-2,4,6,12H,3,5,7-9H2,(H,14,15);(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 | C13H16N2 |
| Molecular Weight | 200.2795 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:01:16 UTC 2023
by
admin
on
Sat Dec 16 10:01:16 UTC 2023
|
| Record UNII |
79V49ERS3O
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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94133-85-4
Created by
admin on Sat Dec 16 10:01:16 UTC 2023 , Edited by admin on Sat Dec 16 10:01:16 UTC 2023
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79V49ERS3O
Created by
admin on Sat Dec 16 10:01:16 UTC 2023 , Edited by admin on Sat Dec 16 10:01:16 UTC 2023
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100000165745
Created by
admin on Sat Dec 16 10:01:16 UTC 2023 , Edited by admin on Sat Dec 16 10:01:16 UTC 2023
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SUB179595
Created by
admin on Sat Dec 16 10:01:16 UTC 2023 , Edited by admin on Sat Dec 16 10:01:16 UTC 2023
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302-749-1
Created by
admin on Sat Dec 16 10:01:16 UTC 2023 , Edited by admin on Sat Dec 16 10:01:16 UTC 2023
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DTXSID90916383
Created by
admin on Sat Dec 16 10:01:16 UTC 2023 , Edited by admin on Sat Dec 16 10:01:16 UTC 2023
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44152200
Created by
admin on Sat Dec 16 10:01:16 UTC 2023 , Edited by admin on Sat Dec 16 10:01:16 UTC 2023
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| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |