Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C29H28N2O8 |
Molecular Weight | 532.5412 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H](N(CC(O)=O)C(=O)OC1=CC=C(O)C=C1)C2=CC=C(OCCC3=C(CO)OC(=N3)C4=CC=CC=C4)C=C2
InChI
InChIKey=JXDHIICOTMYQGD-IBGZPJMESA-N
InChI=1S/C29H28N2O8/c1-19(31(17-27(34)35)29(36)38-24-13-9-22(33)10-14-24)20-7-11-23(12-8-20)37-16-15-25-26(18-32)39-28(30-25)21-5-3-2-4-6-21/h2-14,19,32-33H,15-18H2,1H3,(H,34,35)/t19-/m0/s1
Molecular Formula | C29H28N2O8 |
Molecular Weight | 532.5412 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:04:36 GMT 2023
by
admin
on
Sat Dec 16 16:04:36 GMT 2023
|
Record UNII |
7538A4GO49
|
Record Status |
Validated (UNII)
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Record Version |
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-
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118753115
Created by
admin on Sat Dec 16 16:04:36 GMT 2023 , Edited by admin on Sat Dec 16 16:04:36 GMT 2023
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7538A4GO49
Created by
admin on Sat Dec 16 16:04:36 GMT 2023 , Edited by admin on Sat Dec 16 16:04:36 GMT 2023
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1807608-02-1
Created by
admin on Sat Dec 16 16:04:36 GMT 2023 , Edited by admin on Sat Dec 16 16:04:36 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
TRACE
URINE
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PARENT -> METABOLITE |
6.13% of dose in group 1 and 2.33% of the dose in group 2
FECAL
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