Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C18H20O10 |
| Molecular Weight | 396.3454 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@@H]1[C@@H](O)[C@H](OC(=O)CCCC2OC(=O)C3=C2C=CC=C3)O[C@@H]([C@H]1O)C(O)=O
InChI
InChIKey=PRFNHGIXAAGIHZ-CPQFSKGLSA-N
InChI=1S/C18H20O10/c19-11(27-18-14(22)12(20)13(21)15(28-18)16(23)24)7-3-6-10-8-4-1-2-5-9(8)17(25)26-10/h1-2,4-5,10,12-15,18,20-22H,3,6-7H2,(H,23,24)/t10?,12-,13-,14+,15-,18+/m0/s1
| Molecular Formula | C18H20O10 |
| Molecular Weight | 396.3454 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:05:30 GMT 2023
by
admin
on
Sat Dec 16 16:05:30 GMT 2023
|
| Record UNII |
L9S7HZ83TD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Systematic Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
156028112
Created by
admin on Sat Dec 16 16:05:30 GMT 2023 , Edited by admin on Sat Dec 16 16:05:30 GMT 2023
|
PRIMARY | |||
|
1486519-57-6
Created by
admin on Sat Dec 16 16:05:30 GMT 2023 , Edited by admin on Sat Dec 16 16:05:30 GMT 2023
|
PRIMARY | |||
|
L9S7HZ83TD
Created by
admin on Sat Dec 16 16:05:30 GMT 2023 , Edited by admin on Sat Dec 16 16:05:30 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MAJOR
URINE
|
