Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C26H27NO10 |
| Molecular Weight | 513.4933 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C([O-])=O)C=C3C(CC[N+]4=C3C=C5C=CC(OC)=C(OC)C5=C4)=C1
InChI
InChIKey=KIEIFABKZNDGQL-SNYRDRRFSA-N
InChI=1S/C26H27NO10/c1-33-17-5-4-12-8-16-14-10-19(36-26-22(30)20(28)21(29)24(37-26)25(31)32)18(34-2)9-13(14)6-7-27(16)11-15(12)23(17)35-3/h4-5,8-11,20-22,24,26,28-30H,6-7H2,1-3H3/t20-,21-,22+,24-,26+/m0/s1
| Molecular Formula | C26H27NO10 |
| Molecular Weight | 513.4933 |
| 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 16:00:37 GMT 2023
by
admin
on
Sat Dec 16 16:00:37 GMT 2023
|
| Record UNII |
X052MG5M30
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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X052MG5M30
Created by
admin on Sat Dec 16 16:00:37 GMT 2023 , Edited by admin on Sat Dec 16 16:00:37 GMT 2023
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1334431-47-8
Created by
admin on Sat Dec 16 16:00:37 GMT 2023 , Edited by admin on Sat Dec 16 16:00:37 GMT 2023
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154572884
Created by
admin on Sat Dec 16 16:00:37 GMT 2023 , Edited by admin on Sat Dec 16 16:00:37 GMT 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
URINE
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