Details
Stereochemistry | UNKNOWN |
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(OCC(O)C3=C(CO)OC(=N3)C4=CC=CC=C4)C=C2)C=C1
InChI
InChIKey=OODRCEMTQNDYEZ-UHFFFAOYSA-N
InChI=1S/C29H28N2O9/c1-37-21-11-13-23(14-12-21)39-29(36)31(16-26(34)35)15-19-7-9-22(10-8-19)38-18-24(33)27-25(17-32)40-28(30-27)20-5-3-2-4-6-20/h2-14,24,32-33H,15-18H2,1H3,(H,34,35)
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
Sat Dec 16 16:09:57 GMT 2023
by
admin
on
Sat Dec 16 16:09:57 GMT 2023
|
Record UNII |
MVY96B1KA0
|
Record Status |
Validated (UNII)
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Record Version |
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-
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875430-17-4
Created by
admin on Sat Dec 16 16:09:57 GMT 2023 , Edited by admin on Sat Dec 16 16:09:57 GMT 2023
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MVY96B1KA0
Created by
admin on Sat Dec 16 16:09:57 GMT 2023 , Edited by admin on Sat Dec 16 16:09:57 GMT 2023
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44448635
Created by
admin on Sat Dec 16 16:09:57 GMT 2023 , Edited by admin on Sat Dec 16 16:09:57 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
FECAL
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