Details
Stereochemistry | ACHIRAL |
Molecular Formula | C29H28N2O9 |
Molecular Weight | 548.5406 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=C(OC(=O)N(CC(O)=O)CC2=CC=C(OCCC3=C(CO)OC(=N3)C4=CC=C(O)C=C4)C=C2)C=C1
InChI
InChIKey=REYODLMMIVHAOF-UHFFFAOYSA-N
InChI=1S/C29H28N2O9/c1-37-22-10-12-24(13-11-22)39-29(36)31(17-27(34)35)16-19-2-8-23(9-3-19)38-15-14-25-26(18-32)40-28(30-25)20-4-6-21(33)7-5-20/h2-13,32-33H,14-18H2,1H3,(H,34,35)
Molecular Formula | C29H28N2O9 |
Molecular Weight | 548.5406 |
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
Sat Dec 16 16:31:22 GMT 2023
by
admin
on
Sat Dec 16 16:31:22 GMT 2023
|
Record UNII |
L3JL99RG9Q
|
Record Status |
Validated (UNII)
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Record Version |
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-
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875430-21-0
Created by
admin on Sat Dec 16 16:31:22 GMT 2023 , Edited by admin on Sat Dec 16 16:31:22 GMT 2023
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L3JL99RG9Q
Created by
admin on Sat Dec 16 16:31:22 GMT 2023 , Edited by admin on Sat Dec 16 16:31:22 GMT 2023
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136036587
Created by
admin on Sat Dec 16 16:31:22 GMT 2023 , Edited by admin on Sat Dec 16 16:31:22 GMT 2023
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Related Record | Type | Details | ||
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PARENT -> METABOLITE |
FECAL
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PARENT -> METABOLITE |
TRACE AMOUNT
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