Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C29H28N2O9 |
| Molecular Weight | 548.5406 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=C(OC(=O)N(CC(O)=O)CC2=CC=C(OC(O)CC3=C(CO)OC(=N3)C4=CC=CC=C4)C=C2)C=C1
InChI
InChIKey=FQNOEHYLLLQCIJ-UHFFFAOYSA-N
InChI=1S/C29H28N2O9/c1-37-21-11-13-23(14-12-21)39-29(36)31(17-26(33)34)16-19-7-9-22(10-8-19)38-27(35)15-24-25(18-32)40-28(30-24)20-5-3-2-4-6-20/h2-14,27,32,35H,15-18H2,1H3,(H,33,34)
| Molecular Formula | C29H28N2O9 |
| Molecular Weight | 548.5406 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 08:01:55 GMT 2025
by
admin
on
Wed Apr 02 08:01:55 GMT 2025
|
| Record UNII |
7RYD35AZJ9
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
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44448664
Created by
admin on Wed Apr 02 08:01:55 GMT 2025 , Edited by admin on Wed Apr 02 08:01:55 GMT 2025
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1222686-00-1
Created by
admin on Wed Apr 02 08:01:55 GMT 2025 , Edited by admin on Wed Apr 02 08:01:55 GMT 2025
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7RYD35AZJ9
Created by
admin on Wed Apr 02 08:01:55 GMT 2025 , Edited by admin on Wed Apr 02 08:01:55 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
FECAL
|