Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H32FNO10 |
| Molecular Weight | 597.5849 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H](C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C3=CC=CC=C3N=C1C4CC4)CC(=O)O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O
InChI
InChIKey=QBNFJKKTKRSBGF-SEKOGJSVSA-N
InChI=1S/C31H32FNO10/c32-17-9-7-15(8-10-17)24-20-3-1-2-4-22(20)33-25(16-5-6-16)21(24)12-11-18(34)13-19(35)14-23(36)42-31-28(39)26(37)27(38)29(43-31)30(40)41/h1-4,7-12,16,18-19,26-29,31,34-35,37-39H,5-6,13-14H2,(H,40,41)/b12-11+/t18-,19-,26+,27+,28-,29+,31-/m1/s1
| Molecular Formula | C31H32FNO10 |
| Molecular Weight | 597.5849 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:46:59 UTC 2023
by
admin
on
Sat Dec 16 14:46:59 UTC 2023
|
| Record UNII |
BN4M24Z4TQ
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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574752-66-2
Created by
admin on Sat Dec 16 14:46:59 UTC 2023 , Edited by admin on Sat Dec 16 14:46:59 UTC 2023
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BN4M24Z4TQ
Created by
admin on Sat Dec 16 14:46:59 UTC 2023 , Edited by admin on Sat Dec 16 14:46:59 UTC 2023
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131881387
Created by
admin on Sat Dec 16 14:46:59 UTC 2023 , Edited by admin on Sat Dec 16 14:46:59 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
URINE
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