Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C20H24N2O2.C3H6O3 |
| Molecular Weight | 414.4947 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(O)C(O)=O.[H][C@]1(C[C@@H]2CC[N@]1C[C@@H]2C=C)[C@H](O)C3=C4C=C(OC)C=CC4=NC=C3
InChI
InChIKey=ZIDGEHZBXVXPFQ-DSXUQNDKSA-N
InChI=1S/C20H24N2O2.C3H6O3/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-2(4)3(5)6/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;2,4H,1H3,(H,5,6)/t13-,14-,19-,20+;/m0./s1
| Molecular Formula | C3H6O3 |
| Molecular Weight | 90.0779 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| Molecular Formula | C20H24N2O2 |
| Molecular Weight | 324.4168 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:24:36 UTC 2023
by
admin
on
Sat Dec 16 09:24:36 UTC 2023
|
| Record UNII |
7J99Y4IZE5
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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23617236
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749-49-5
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DTXSID20225874
Created by
admin on Sat Dec 16 09:24:36 UTC 2023 , Edited by admin on Sat Dec 16 09:24:36 UTC 2023
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7J99Y4IZE5
Created by
admin on Sat Dec 16 09:24:36 UTC 2023 , Edited by admin on Sat Dec 16 09:24:36 UTC 2023
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PRIMARY |
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