Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H19NO3.C2H4O2 |
Molecular Weight | 345.3896 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(O)=O.[H][C@@]12OC3=C4C(C[C@H]5N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3O
InChI
InChIKey=CLDOGJORCNORLA-VYKNHSEDSA-N
InChI=1S/C17H19NO3.C2H4O2/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18;1-2(3)4/h2-5,10-11,13,16,19-20H,6-8H2,1H3;1H3,(H,3,4)/t10-,11+,13-,16-,17-;/m0./s1
Molecular Formula | C2H4O2 |
Molecular Weight | 60.052 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C17H19NO3 |
Molecular Weight | 285.3377 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:14:54 UTC 2023
by
admin
on
Fri Dec 15 15:14:54 UTC 2023
|
Record UNII |
VEO43W5229
|
Record Status |
Validated (UNII)
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Record Version |
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-
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VEO43W5229
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DBSALT002224
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596-15-6
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209-878-1
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100000142733
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SUB117314
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DTXSID30208274
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C575658
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5359475
Created by
admin on Fri Dec 15 15:14:54 UTC 2023 , Edited by admin on Fri Dec 15 15:14:54 UTC 2023
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |