Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C28H31FN6O11 |
| Molecular Weight | 646.5777 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC(NC2=NC=C(F)C(NC3=CC=C4OC(C)(C)C(=O)N([C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O)C4=N3)=N2)=CC(OC)=C1OC
InChI
InChIKey=CATCJHZEXNDJNV-HMUJTRMMSA-N
InChI=1S/C28H31FN6O11/c1-28(2)26(41)35(24-19(38)17(36)18(37)21(45-24)25(39)40)23-13(46-28)6-7-16(33-23)32-22-12(29)10-30-27(34-22)31-11-8-14(42-3)20(44-5)15(9-11)43-4/h6-10,17-19,21,24,36-38H,1-5H3,(H,39,40)(H2,30,31,32,33,34)/t17-,18-,19+,21-,24+/m0/s1
| Molecular Formula | C28H31FN6O11 |
| Molecular Weight | 646.5777 |
| 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 16:40:59 GMT 2023
by
admin
on
Sat Dec 16 16:40:59 GMT 2023
|
| Record UNII |
ZP3U7X9EAM
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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146675086
Created by
admin on Sat Dec 16 16:40:59 GMT 2023 , Edited by admin on Sat Dec 16 16:40:59 GMT 2023
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PRIMARY | |||
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1293999-42-4
Created by
admin on Sat Dec 16 16:40:59 GMT 2023 , Edited by admin on Sat Dec 16 16:40:59 GMT 2023
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PRIMARY | |||
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ZP3U7X9EAM
Created by
admin on Sat Dec 16 16:40:59 GMT 2023 , Edited by admin on Sat Dec 16 16:40:59 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
PLASMA; URINE
|
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|
PARENT -> METABOLITE |
PLASMA; URINE
|
