Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H25ClO8 |
| Molecular Weight | 452.882 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOC1=CC=C(C=C1)[C@H](O)C2=CC(=CC=C2Cl)[C@]34OC[C@](CO)(O3)[C@@H](O)[C@H](O)[C@H]4O
InChI
InChIKey=XLJINMDXOSTAIJ-BPIQYHPVSA-N
InChI=1S/C22H25ClO8/c1-2-29-14-6-3-12(4-7-14)17(25)15-9-13(5-8-16(15)23)22-20(28)18(26)19(27)21(10-24,31-22)11-30-22/h3-9,17-20,24-28H,2,10-11H2,1H3/t17-,18-,19-,20+,21-,22-/m0/s1
| Molecular Formula | C22H25ClO8 |
| Molecular Weight | 452.882 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:23:27 GMT 2023
by
admin
on
Sat Dec 16 14:23:27 GMT 2023
|
| Record UNII |
5U4GBN5SYC
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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5U4GBN5SYC
Created by
admin on Sat Dec 16 14:23:27 GMT 2023 , Edited by admin on Sat Dec 16 14:23:27 GMT 2023
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1298086-34-6
Created by
admin on Sat Dec 16 14:23:27 GMT 2023 , Edited by admin on Sat Dec 16 14:23:27 GMT 2023
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67153944
Created by
admin on Sat Dec 16 14:23:27 GMT 2023 , Edited by admin on Sat Dec 16 14:23:27 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
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