Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H30O5 |
| Molecular Weight | 362.4599 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H](CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CC(O)=O)CCC2=CC=CC=C2
InChI
InChIKey=OFWJWONOOHEBFJ-PIUGYIEYSA-N
InChI=1S/C21H30O5/c22-16(11-10-15-6-2-1-3-7-15)12-13-18-17(19(23)14-20(18)24)8-4-5-9-21(25)26/h1-7,16-20,22-24H,8-14H2,(H,25,26)/b5-4-/t16-,17+,18+,19-,20+/m0/s1
| Molecular Formula | C21H30O5 |
| Molecular Weight | 362.4599 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:03:53 GMT 2023
by
admin
on
Sat Dec 16 09:03:53 GMT 2023
|
| Record UNII |
65SZ481V2C
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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65SZ481V2C
Created by
admin on Sat Dec 16 09:03:53 GMT 2023 , Edited by admin on Sat Dec 16 09:03:53 GMT 2023
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55349-51-4
Created by
admin on Sat Dec 16 09:03:53 GMT 2023 , Edited by admin on Sat Dec 16 09:03:53 GMT 2023
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DBMET02014
Created by
admin on Sat Dec 16 09:03:53 GMT 2023 , Edited by admin on Sat Dec 16 09:03:53 GMT 2023
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92135775
Created by
admin on Sat Dec 16 09:03:53 GMT 2023 , Edited by admin on Sat Dec 16 09:03:53 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
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PARENT -> METABOLITE |
MAJOR
FECAL; URINE
|
