Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C9H8O4.C6H14N2O2 |
| Molecular Weight | 326.345 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCCCC(N)C(O)=O.CC(=O)OC1=CC=CC=C1C(O)=O
InChI
InChIKey=JJBCTCGUOQYZHK-UHFFFAOYSA-N
InChI=1S/C9H8O4.C6H14N2O2/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;7-4-2-1-3-5(8)6(9)10/h2-5H,1H3,(H,11,12);5H,1-4,7-8H2,(H,9,10)
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C263
Created by
admin on Fri Dec 15 17:26:37 UTC 2023 , Edited by admin on Fri Dec 15 17:26:37 UTC 2023
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SUB12727MIG
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44219
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SUB34053
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admin on Fri Dec 15 17:26:37 UTC 2023 , Edited by admin on Fri Dec 15 17:26:37 UTC 2023
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m6968
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admin on Fri Dec 15 17:26:37 UTC 2023 , Edited by admin on Fri Dec 15 17:26:37 UTC 2023
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C91032
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2JJ274J145
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DTXSID50886518
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62952-06-1
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100000091435
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263-769-3
Created by
admin on Fri Dec 15 17:26:37 UTC 2023 , Edited by admin on Fri Dec 15 17:26:37 UTC 2023
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ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
