Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H25NO4.ClH |
| Molecular Weight | 391.888 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=CC2=C(CCN3CC4=C(OC)C(OC)=CC=C4[C@H](C)[C@H]23)C=C1O
InChI
InChIKey=BBWAVTIPBODMET-XVHUJMMASA-N
InChI=1S/C21H25NO4.ClH/c1-12-14-5-6-18(24-2)21(26-4)16(14)11-22-8-7-13-9-17(23)19(25-3)10-15(13)20(12)22;/h5-6,9-10,12,20,23H,7-8,11H2,1-4H3;1H/t12-,20+;/m0./s1
| 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 |
| Molecular Formula | C21H25NO4 |
| Molecular Weight | 355.4275 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:59:37 GMT 2025
by
admin
on
Mon Mar 31 22:59:37 GMT 2025
|
| Record UNII |
I3T8146658
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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86278128
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5986-03-8
Created by
admin on Mon Mar 31 22:59:37 GMT 2025 , Edited by admin on Mon Mar 31 22:59:37 GMT 2025
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I3T8146658
Created by
admin on Mon Mar 31 22:59:37 GMT 2025 , Edited by admin on Mon Mar 31 22:59:37 GMT 2025
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m125
Created by
admin on Mon Mar 31 22:59:37 GMT 2025 , Edited by admin on Mon Mar 31 22:59:37 GMT 2025
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PRIMARY | Merck Index |