Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C10H12N2.C6H8O7 |
| Molecular Weight | 352.3392 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C1N[C@@H](CC=C1)C2=CC=CN=C2.OC(=O)CC(O)(CC(O)=O)C(O)=O
InChI
InChIKey=FCSIYFXMBFVWPD-PPHPATTJSA-N
InChI=1S/C10H12N2.C6H8O7/c1-2-7-12-10(5-1)9-4-3-6-11-8-9;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-4,6,8,10,12H,5,7H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t10-;/m0./s1
| Molecular Formula | C6H8O7 |
| Molecular Weight | 192.1235 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C10H12N2 |
| Molecular Weight | 160.2157 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:07:10 UTC 2023
by
admin
on
Sat Dec 16 14:07:10 UTC 2023
|
| Record UNII |
MZE7Y8PB3F
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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66627856
Created by
admin on Sat Dec 16 14:07:10 UTC 2023 , Edited by admin on Sat Dec 16 14:07:10 UTC 2023
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PRIMARY | |||
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1354209-03-2
Created by
admin on Sat Dec 16 14:07:10 UTC 2023 , Edited by admin on Sat Dec 16 14:07:10 UTC 2023
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PRIMARY | |||
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MZE7Y8PB3F
Created by
admin on Sat Dec 16 14:07:10 UTC 2023 , Edited by admin on Sat Dec 16 14:07:10 UTC 2023
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PRIMARY | |||
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100000170501
Created by
admin on Sat Dec 16 14:07:10 UTC 2023 , Edited by admin on Sat Dec 16 14:07:10 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 |