Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H31N2O5.Na |
| Molecular Weight | 462.5138 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CCCCCNC(=O)C1=COC(=N1)[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2CC4=C(CCC([O-])=O)C=CC=C4
InChI
InChIKey=WOHSQDNIXPEQAE-QBKVZTCDSA-M
InChI=1S/C25H32N2O5.Na/c1-2-3-6-13-26-24(30)19-15-31-25(27-19)23-18(20-10-11-21(23)32-20)14-17-8-5-4-7-16(17)9-12-22(28)29;/h4-5,7-8,15,18,20-21,23H,2-3,6,9-14H2,1H3,(H,26,30)(H,28,29);/q;+1/p-1/t18-,20-,21+,23-;/m0./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1327
Created by
admin on Fri Dec 15 15:41:38 UTC 2023 , Edited by admin on Fri Dec 15 15:41:38 UTC 2023
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DBSALT002177
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C81569
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156715-37-6
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DTXSID40935504
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48IJA0E92C
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admin on Fri Dec 15 15:41:38 UTC 2023 , Edited by admin on Fri Dec 15 15:41:38 UTC 2023
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GG-97
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23663994
Created by
admin on Fri Dec 15 15:41:38 UTC 2023 , Edited by admin on Fri Dec 15 15:41:38 UTC 2023
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CHEMBL3301673
Created by
admin on Fri Dec 15 15:41:38 UTC 2023 , Edited by admin on Fri Dec 15 15:41:38 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD
