Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C22H27N2O3.Cl |
| Molecular Weight | 402.914 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].COC(=O)C1=CO[C@@H](C)[C@H]2C[N+]3(C)CCC4=C(NC5=C4C=CC=C5)[C@@H]3C[C@H]12
InChI
InChIKey=MEQZFTXZSJSEQT-NTLKUVPSSA-M
InChI=1S/C22H27N2O3.ClH/c1-13-17-11-24(2)9-8-15-14-6-4-5-7-19(14)23-21(15)20(24)10-16(17)18(12-27-13)22(25)26-3;/h4-7,12-13,16-17,20,23H,8-11H2,1-3H3;1H/q+1;/p-1/t13-,16-,17+,20-,24?;/m0./s1
| Molecular Formula | C22H27N2O3 |
| Molecular Weight | 367.4614 |
| Charge | 1 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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
Mon Mar 31 22:49:25 GMT 2025
by
admin
on
Mon Mar 31 22:49:25 GMT 2025
|
| Record UNII |
5B476K30QA
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| Record Status |
Validated (UNII)
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| Record Version |
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m305
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5B476K30QA
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91668154
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114537-53-0
Created by
admin on Mon Mar 31 22:49:25 GMT 2025 , Edited by admin on Mon Mar 31 22:49:25 GMT 2025
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