Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C27H29FN6O11 |
| Molecular Weight | 632.5512 |
| 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)NC4=N3)=N2)=CC(OC)=C1O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O
InChI
InChIKey=JWURLJIMAQXVFK-VAIUHDHXSA-N
InChI=1S/C27H29FN6O11/c1-27(2)25(40)33-22-12(45-27)5-6-15(32-22)31-21-11(28)9-29-26(34-21)30-10-7-13(41-3)19(14(8-10)42-4)43-24-18(37)16(35)17(36)20(44-24)23(38)39/h5-9,16-18,20,24,35-37H,1-4H3,(H,38,39)(H3,29,30,31,32,33,34,40)/t16-,17-,18+,20-,24+/m0/s1
| Molecular Formula | C27H29FN6O11 |
| Molecular Weight | 632.5512 |
| 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
Wed Apr 02 07:11:42 GMT 2025
by
admin
on
Wed Apr 02 07:11:42 GMT 2025
|
| Record UNII |
37YV3YP3TP
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Preferred Name | English | ||
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1293999-45-7
Created by
admin on Wed Apr 02 07:11:42 GMT 2025 , Edited by admin on Wed Apr 02 07:11:42 GMT 2025
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146675084
Created by
admin on Wed Apr 02 07:11:42 GMT 2025 , Edited by admin on Wed Apr 02 07:11:42 GMT 2025
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37YV3YP3TP
Created by
admin on Wed Apr 02 07:11:42 GMT 2025 , Edited by admin on Wed Apr 02 07:11:42 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
|
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PARENT -> METABOLITE |
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