Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H19NO3.CH4O3S |
Molecular Weight | 381.443 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.[H][C@@]12OC3=C4C(C[C@@]5([H])N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3O
InChI
InChIKey=MHEMFNFIWLUDDJ-VYKNHSEDSA-N
InChI=1S/C17H19NO3.CH4O3S/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;1-5(2,3)4/h2-5,10-11,13,16,19-20H,6-8H2,1H3;1H3,(H,2,3,4)/t10-,11+,13-,16-,17-;/m0./s1
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 |
Molecular Formula | CH4O3S |
Molecular Weight | 96.106 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:14:01 UTC 2023
by
admin
on
Sat Dec 16 11:14:01 UTC 2023
|
Record UNII |
QXB8THK8QY
|
Record Status |
Validated (UNII)
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Record Version |
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-
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DEA NO. |
9306
Created by
admin on Sat Dec 16 11:14:01 UTC 2023 , Edited by admin on Sat Dec 16 11:14:01 UTC 2023
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QXB8THK8QY
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9929825
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DBSALT002222
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admin on Sat Dec 16 11:14:01 UTC 2023 , Edited by admin on Sat Dec 16 11:14:01 UTC 2023
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335328-17-1
Created by
admin on Sat Dec 16 11:14:01 UTC 2023 , Edited by admin on Sat Dec 16 11:14:01 UTC 2023
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