Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | 2C13H13N3.3C2H2O4 |
| Molecular Weight | 692.6295 |
| Optical Activity | NONE |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(O)=O.OC(=O)C(O)=O.OC(=O)C(O)=O.C1[C@H]2CNC[C@@H]1C3=CC4=C(C=C23)N=CC=N4.C5[C@H]6CNC[C@@H]5C7=CC8=C(C=C67)N=CC=N8
InChI
InChIKey=VONCTORHQKUKIE-CKIUBZFISA-N
InChI=1S/2C13H13N3.3C2H2O4/c2*1-2-16-13-5-11-9-3-8(6-14-7-9)10(11)4-12(13)15-1;3*3-1(4)2(5)6/h2*1-2,4-5,8-9,14H,3,6-7H2;3*(H,3,4)(H,5,6)/t2*8-,9+;;;
| Molecular Formula | C13H13N3 |
| Molecular Weight | 211.2624 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C2H2O4 |
| Molecular Weight | 90.0349 |
| 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 19:19:17 UTC 2023
by
admin
on
Sat Dec 16 19:19:17 UTC 2023
|
| Record UNII |
BLQ82778XF
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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1185326-16-2
Created by
admin on Sat Dec 16 19:19:17 UTC 2023 , Edited by admin on Sat Dec 16 19:19:17 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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166177245
Created by
admin on Sat Dec 16 19:19:17 UTC 2023 , Edited by admin on Sat Dec 16 19:19:17 UTC 2023
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PRIMARY | |||
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BLQ82778XF
Created by
admin on Sat Dec 16 19:19:17 UTC 2023 , Edited by admin on Sat Dec 16 19:19:17 UTC 2023
|
PRIMARY |
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ACTIVE MOIETY |
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