Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H27ClFNO10S |
| Molecular Weight | 612.02 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(=O)(=O)C1=C2N(CC3=CC=C(Cl)C=C3)C4=C(CC[C@@H]4CC(=O)O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O)C2=CC(F)=C1
InChI
InChIKey=RDLTXMJIVXLRHI-GDIIIJHCSA-N
InChI=1S/C27H27ClFNO10S/c1-41(37,38)18-10-15(29)9-17-16-7-4-13(20(16)30(21(17)18)11-12-2-5-14(28)6-3-12)8-19(31)39-27-24(34)22(32)23(33)25(40-27)26(35)36/h2-3,5-6,9-10,13,22-25,27,32-34H,4,7-8,11H2,1H3,(H,35,36)/t13-,22+,23+,24-,25+,27-/m1/s1
| Molecular Formula | C27H27ClFNO10S |
| Molecular Weight | 612.02 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:25:44 GMT 2023
by
admin
on
Sat Dec 16 16:25:44 GMT 2023
|
| Record UNII |
EPX0008MOI
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Systematic Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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EPX0008MOI
Created by
admin on Sat Dec 16 16:25:45 GMT 2023 , Edited by admin on Sat Dec 16 16:25:45 GMT 2023
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PRIMARY | |||
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901779-02-0
Created by
admin on Sat Dec 16 16:25:45 GMT 2023 , Edited by admin on Sat Dec 16 16:25:45 GMT 2023
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PRIMARY | |||
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102385138
Created by
admin on Sat Dec 16 16:25:45 GMT 2023 , Edited by admin on Sat Dec 16 16:25:45 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
PLASMA
|
||
|
PARENT -> METABOLITE |
MAJOR
URINE
|
