Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C18H21NO3.BrH |
Molecular Weight | 380.276 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Br.[H][C@@]12OC3=C4C(C[C@H]5N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3OC
InChI
InChIKey=XOXNTPXYPCJBHI-FFHNEAJVSA-N
InChI=1S/C18H21NO3.BrH/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;/h3-6,11-13,17,20H,7-9H2,1-2H3;1H/t11-,12+,13-,17-,18-;/m0./s1
Molecular Formula | C18H21NO3 |
Molecular Weight | 299.3642 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | BrH |
Molecular Weight | 80.912 |
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
Fri Dec 15 18:35:31 UTC 2023
by
admin
on
Fri Dec 15 18:35:31 UTC 2023
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Record UNII |
8HOK0TIN61
|
Record Status |
Validated (UNII)
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Record Version |
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-
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204-730-2
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5464192
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100000079771
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SUB13426MIG
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admin on Fri Dec 15 18:35:32 UTC 2023 , Edited by admin on Fri Dec 15 18:35:32 UTC 2023
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8HOK0TIN61
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admin on Fri Dec 15 18:35:32 UTC 2023 , Edited by admin on Fri Dec 15 18:35:32 UTC 2023
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125-25-7
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DTXSID90154541
Created by
admin on Fri Dec 15 18:35:32 UTC 2023 , Edited by admin on Fri Dec 15 18:35:32 UTC 2023
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ACTIVE MOIETY |