Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C6H10O3.C6H9N3O2 |
Molecular Weight | 285.2964 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)CC(=O)C(O)=O.N[C@@H](CC1=CNC=N1)C(O)=O
InChI
InChIKey=SEGLGXWKMQWPCB-JEDNCBNOSA-N
InChI=1S/C6H9N3O2.C6H10O3/c7-5(6(10)11)1-4-2-8-3-9-4;1-4(2)3-5(7)6(8)9/h2-3,5H,1,7H2,(H,8,9)(H,10,11);4H,3H2,1-2H3,(H,8,9)/t5-;/m0./s1
Molecular Formula | C6H10O3 |
Molecular Weight | 130.1418 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C6H9N3O2 |
Molecular Weight | 155.1546 |
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
Fri Dec 15 15:02:04 GMT 2023
by
admin
on
Fri Dec 15 15:02:04 GMT 2023
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Record UNII |
4CO6A4A042
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Code System | Code | Type | Description | ||
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DTXSID70228658
Created by
admin on Fri Dec 15 15:02:04 GMT 2023 , Edited by admin on Fri Dec 15 15:02:04 GMT 2023
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PRIMARY | |||
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122252-28-2
Created by
admin on Fri Dec 15 15:02:04 GMT 2023 , Edited by admin on Fri Dec 15 15:02:04 GMT 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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14406342
Created by
admin on Fri Dec 15 15:02:04 GMT 2023 , Edited by admin on Fri Dec 15 15:02:04 GMT 2023
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PRIMARY | |||
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78000-40-5
Created by
admin on Fri Dec 15 15:02:04 GMT 2023 , Edited by admin on Fri Dec 15 15:02:04 GMT 2023
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PRIMARY | |||
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278-816-3
Created by
admin on Fri Dec 15 15:02:04 GMT 2023 , Edited by admin on Fri Dec 15 15:02:04 GMT 2023
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PRIMARY | |||
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4CO6A4A042
Created by
admin on Fri Dec 15 15:02:04 GMT 2023 , Edited by admin on Fri Dec 15 15:02:04 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |