Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H36N2O6 |
| Molecular Weight | 484.5845 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOC1=C(C=CC(CC(=O)N[C@@H](CC(C)C)C2=C(NCCCCC(O)=O)C=CC=C2)=C1)C(O)=O
InChI
InChIKey=ZOMBGPVQRXZSGW-QHCPKHFHSA-N
InChI=1S/C27H36N2O6/c1-4-35-24-16-19(12-13-21(24)27(33)34)17-25(30)29-23(15-18(2)3)20-9-5-6-10-22(20)28-14-8-7-11-26(31)32/h5-6,9-10,12-13,16,18,23,28H,4,7-8,11,14-15,17H2,1-3H3,(H,29,30)(H,31,32)(H,33,34)/t23-/m0/s1
| Molecular Formula | C27H36N2O6 |
| Molecular Weight | 484.5845 |
| 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 09:09:49 UTC 2023
by
admin
on
Sat Dec 16 09:09:49 UTC 2023
|
| Record UNII |
59Z4129VWK
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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29977672
Created by
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1363721-68-9
Created by
admin on Sat Dec 16 09:09:49 UTC 2023 , Edited by admin on Sat Dec 16 09:09:49 UTC 2023
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59Z4129VWK
Created by
admin on Sat Dec 16 09:09:49 UTC 2023 , Edited by admin on Sat Dec 16 09:09:49 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE INACTIVE |
CYP2C8 and 3A4 in vitro
MAJOR
FECAL
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