Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C14H18N6O.C4H6O4 |
| Molecular Weight | 404.4204 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CCC(O)=O.NC1=NC2=C(N=CN2[C@@H]3C[C@H](CO)C=C3)C(NC4CC4)=N1
InChI
InChIKey=BOONDNCXQPMXQT-SCYNACPDSA-N
InChI=1S/C14H18N6O.C4H6O4/c15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21;5-3(6)1-2-4(7)8/h1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19);1-2H2,(H,5,6)(H,7,8)/t8-,10+;/m1./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C97452
Created by
admin on Fri Dec 15 15:53:20 UTC 2023 , Edited by admin on Fri Dec 15 15:53:20 UTC 2023
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| Code System | Code | Type | Description | ||
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40FH6D8CHK
Created by
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DTXSID10937454
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100000089384
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9822500
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C71608
Created by
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SUB25392
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168146-84-7
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admin on Fri Dec 15 15:53:20 UTC 2023 , Edited by admin on Fri Dec 15 15:53:20 UTC 2023
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CHEMBL1380
Created by
admin on Fri Dec 15 15:53:20 UTC 2023 , Edited by admin on Fri Dec 15 15:53:20 UTC 2023
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II-25
Created by
admin on Fri Dec 15 15:53:20 UTC 2023 , Edited by admin on Fri Dec 15 15:53:20 UTC 2023
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C106538
Created by
admin on Fri Dec 15 15:53:20 UTC 2023 , Edited by admin on Fri Dec 15 15:53:20 UTC 2023
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PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
