Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H28NO4 |
| Molecular Weight | 358.4513 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 1 |
SHOW SMILES / InChI
SMILES
C[N@+]2(CC1CC1)CC[C@]34[C@H]5OC6=C(O)C=CC(C[C@@H]2[C@]3(O)CC[C@H]5O)=C46
InChI
InChIKey=ZDECYIARZVKYGM-PEFXOJROSA-O
InChI=1S/C21H27NO4/c1-22(11-12-2-3-12)9-8-20-17-13-4-5-14(23)18(17)26-19(20)15(24)6-7-21(20,25)16(22)10-13/h4-5,12,15-16,19,24-25H,2-3,6-11H2,1H3/p+1/t15-,16-,19+,20+,21-,22-/m1/s1
| Molecular Formula | C21H28NO4 |
| Molecular Weight | 358.4513 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 05:58:53 GMT 2025
by
admin
on
Wed Apr 02 05:58:53 GMT 2025
|
| Record UNII |
QC5L0W1IMT
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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Common Name | English | ||
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Preferred Name | English |
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68256000
Created by
admin on Wed Apr 02 05:58:53 GMT 2025 , Edited by admin on Wed Apr 02 05:58:53 GMT 2025
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PRIMARY | |||
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QC5L0W1IMT
Created by
admin on Wed Apr 02 05:58:53 GMT 2025 , Edited by admin on Wed Apr 02 05:58:53 GMT 2025
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PRIMARY |
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IONIC MOIETY |
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PARENT -> METABOLITE |