Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C32H41ClN4O8 |
| Molecular Weight | 645.143 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CN=C(O[C@@H]2C[C@H](N(C2)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)N[C@@]3(C[C@H]3C=C)C(O)=O)C4=C1C=CC(Cl)=C4
InChI
InChIKey=FJEHWMLXYSFPBD-YJTAAIAXSA-N
InChI=1S/C32H41ClN4O8/c1-9-17-14-32(17,28(40)41)36-25(38)22-13-19(44-26-21-12-18(33)10-11-20(21)23(43-8)15-34-26)16-37(22)27(39)24(30(2,3)4)35-29(42)45-31(5,6)7/h9-12,15,17,19,22,24H,1,13-14,16H2,2-8H3,(H,35,42)(H,36,38)(H,40,41)/t17-,19-,22+,24-,32-/m1/s1
| Molecular Formula | C32H41ClN4O8 |
| Molecular Weight | 645.143 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:32:50 GMT 2023
by
admin
on
Sat Dec 16 19:32:50 GMT 2023
|
| Record UNII |
HFP3LEB9NU
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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HFP3LEB9NU
Created by
admin on Sat Dec 16 19:32:50 GMT 2023 , Edited by admin on Sat Dec 16 19:32:50 GMT 2023
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PRIMARY | |||
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166451458
Created by
admin on Sat Dec 16 19:32:50 GMT 2023 , Edited by admin on Sat Dec 16 19:32:50 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MAJOR
FECAL
|
