Details
Stereochemistry | EPIMERIC |
Molecular Formula | C21H30NO4.NO3 |
Molecular Weight | 422.4721 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[O-][N+]([O-])=O.CCC(=O)OCC(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)C3=CC=CC=C3
InChI
InChIKey=AXCHOJUOJVCJQD-HROLNALNSA-N
InChI=1S/C21H30NO4.NO3/c1-4-20(23)25-14-19(15-8-6-5-7-9-15)21(24)26-18-12-16-10-11-17(13-18)22(16,2)3;2-1(3)4/h5-9,16-19H,4,10-14H2,1-3H3;/q+1;-1/t16-,17+,18+,19?;
Molecular Formula | NO3 |
Molecular Weight | 62.0049 |
Charge | -1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C21H30NO4 |
Molecular Weight | 360.4672 |
Charge | 1 |
Count |
|
Stereochemistry | MIXED |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 12:37:28 GMT 2023
by
admin
on
Sat Dec 16 12:37:28 GMT 2023
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Record UNII |
6NX0FYI1SE
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Record Status |
Validated (UNII)
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Record Version |
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-
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203400
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DTXSID40931768
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14319-87-0
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admin on Sat Dec 16 12:37:28 GMT 2023 , Edited by admin on Sat Dec 16 12:37:28 GMT 2023
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6NX0FYI1SE
Created by
admin on Sat Dec 16 12:37:28 GMT 2023 , Edited by admin on Sat Dec 16 12:37:28 GMT 2023
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