Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H23NO.C4H6O6.2H2O |
| Molecular Weight | 443.488 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O[C@H]([C@@H](O)C(O)=O)C(O)=O.[H][C@@]12CCCC[C@@]13CCN(C)[C@@H]2CC4=C3C=C(O)C=C4
InChI
InChIKey=UMZNDVASJKIQCB-QLFXFZCRSA-N
InChI=1S/C17H23NO.C4H6O6.2H2O/c1-18-9-8-17-7-3-2-4-14(17)16(18)10-12-5-6-13(19)11-15(12)17;5-1(3(7)8)2(6)4(9)10;;/h5-6,11,14,16,19H,2-4,7-10H2,1H3;1-2,5-6H,(H,7,8)(H,9,10);2*1H2/t14-,16+,17+;1-,2-;;/m01../s1
Approval Year
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C1506
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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NCI_THESAURUS |
C67413
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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5985-38-6
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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100000086127
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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m6794
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | Merck Index | ||
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DTXSID30975252
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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DBSALT000935
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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04WQU6T9QI
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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6700-40-9
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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SUPERSEDED | |||
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04WQU6T9QI
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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153973
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | RxNorm | ||
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5985-51-3
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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SUPERSEDED | |||
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5462348
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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C47586
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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1364007
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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SUB02914MIG
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY | |||
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CHEMBL592
Created by
admin on Fri Dec 15 15:33:59 UTC 2023 , Edited by admin on Fri Dec 15 15:33:59 UTC 2023
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PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
