Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H22O8 |
Molecular Weight | 414.4053 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]12COC(=O)[C@@]1([H])[C@H](C3=CC(OC)=C(OC)C(OC)=C3)C4=C(C=C5OCOC5=C4)[C@@H]2O
InChI
InChIKey=YJGVMLPVUAXIQN-HAEOHBJNSA-N
InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19+,20-/m0/s1
Molecular Formula | C22H22O8 |
Molecular Weight | 414.4053 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:19:47 UTC 2023
by
admin
on
Fri Dec 15 15:19:47 UTC 2023
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Record UNII |
0F35AOI227
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1331
Created by
admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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FDA ORPHAN DRUG |
593617
Created by
admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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NCI_THESAURUS |
C1967
Created by
admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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EU-Orphan Drug |
EU/3/17/1904
Created by
admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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Code System | Code | Type | Description | ||
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DTXSID80197245
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PRIMARY | |||
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C415032
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75251
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72435
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0F35AOI227
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SUB33043
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100000126372
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PRIMARY | |||
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m8933
Created by
admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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PRIMARY | Merck Index | ||
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DB12802
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477-47-4
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36407
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admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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CHEMBL283120
Created by
admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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PRIMARY | |||
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C87736
Created by
admin on Fri Dec 15 15:19:47 UTC 2023 , Edited by admin on Fri Dec 15 15:19:47 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|