Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C30H35NO3.ClH |
| Molecular Weight | 494.065 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=CC2=C(C=C1)[C@@H]([C@H](C3=CC=CC=C3)C(C)(C)O2)C4=CC=C(OCCN5CCCC5)C=C4
InChI
InChIKey=ZRGUGBSQWQXLHB-OCPPCWRMSA-N
InChI=1S/C30H35NO3.ClH/c1-30(2)29(23-9-5-4-6-10-23)28(26-16-15-25(32-3)21-27(26)34-30)22-11-13-24(14-12-22)33-20-19-31-17-7-8-18-31;/h4-6,9-16,21,28-29H,7-8,17-20H2,1-3H3;1H/t28-,29-;/m0./s1
| Molecular Formula | C30H35NO3 |
| Molecular Weight | 457.6038 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| 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 23:23:28 GMT 2025
by
admin
on
Mon Mar 31 23:23:28 GMT 2025
|
| Record UNII |
JFJ9VA7B3G
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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51423-19-9
Created by
admin on Mon Mar 31 23:23:28 GMT 2025 , Edited by admin on Mon Mar 31 23:23:28 GMT 2025
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JFJ9VA7B3G
Created by
admin on Mon Mar 31 23:23:28 GMT 2025 , Edited by admin on Mon Mar 31 23:23:28 GMT 2025
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PRIMARY |