Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C20H16N6O4.C6H14N4O2 |
Molecular Weight | 578.5798 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H](CCCNC(N)=N)C(O)=O.COC1=C(OC2=C1N(C3=CC=C(OC)C=C23)C4=CC=CC=C4)C(=O)NC5=NN=NN5
InChI
InChIKey=OLFPNWJCEUTPNJ-VWMHFEHESA-N
InChI=1S/C20H16N6O4.C6H14N4O2/c1-28-12-8-9-14-13(10-12)16-15(26(14)11-6-4-3-5-7-11)17(29-2)18(30-16)19(27)21-20-22-24-25-23-20;7-4(5(11)12)2-1-3-10-6(8)9/h3-10H,1-2H3,(H2,21,22,23,24,25,27);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t;4-/m.0/s1
Molecular Formula | C20H16N6O4 |
Molecular Weight | 404.3788 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C6H14N4O2 |
Molecular Weight | 174.201 |
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 15:02:07 UTC 2023
by
admin
on
Fri Dec 15 15:02:07 UTC 2023
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Record UNII |
5VC7KY707F
|
Record Status |
Validated (UNII)
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Record Version |
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-
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97958-08-2
Created by
admin on Fri Dec 15 15:02:07 UTC 2023 , Edited by admin on Fri Dec 15 15:02:07 UTC 2023
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5VC7KY707F
Created by
admin on Fri Dec 15 15:02:07 UTC 2023 , Edited by admin on Fri Dec 15 15:02:07 UTC 2023
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DTXSID60913526
Created by
admin on Fri Dec 15 15:02:07 UTC 2023 , Edited by admin on Fri Dec 15 15:02:07 UTC 2023
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146938
Created by
admin on Fri Dec 15 15:02:07 UTC 2023 , Edited by admin on Fri Dec 15 15:02:07 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |