Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H26F3N3O11 |
| Molecular Weight | 625.5051 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C1C[C@]2([H])C[C@@]1([H])N3[C@@]([H])(Cn4cc(c(=O)c(c4C3=O)O[C@@]5([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O)O5)O)O)O)C(=NCc6c(cc(cc6F)F)F)O)O2
InChI
InChIKey=ADNKJYGVXJPWAW-JKLDJCBUSA-N
InChI=1S/C27H26F3N3O11/c28-9-3-14(29)12(15(30)4-9)6-31-24(38)13-7-32-8-16-33(10-1-2-11(5-10)42-16)25(39)17(32)22(18(13)34)43-27-21(37)19(35)20(36)23(44-27)26(40)41/h3-4,7,10-11,16,19-21,23,27,35-37H,1-2,5-6,8H2,(H,31,38)(H,40,41)/t10-,11+,16+,19-,20-,21+,23-,27+/m0/s1
| Molecular Formula | C27H26F3N3O11 |
| Molecular Weight | 625.5051 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Jun 26 16:36:25 UTC 2021
by
admin
on
Sat Jun 26 16:36:25 UTC 2021
|
| Record UNII |
TD2G64J9XN
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Common Name | English |
| Code System | Code | Type | Description | ||
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139337241
Created by
admin on Sat Jun 26 16:36:25 UTC 2021 , Edited by admin on Sat Jun 26 16:36:25 UTC 2021
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PRIMARY | PUBCHEM | ||
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2365156-60-9
Created by
admin on Sat Jun 26 16:36:25 UTC 2021 , Edited by admin on Sat Jun 26 16:36:25 UTC 2021
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PRIMARY | |||
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TD2G64J9XN
Created by
admin on Sat Jun 26 16:36:25 UTC 2021 , Edited by admin on Sat Jun 26 16:36:25 UTC 2021
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> METABOLITE |
PLASMA
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