Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H22O12 |
Molecular Weight | 478.4037 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COc1cc(ccc1O)-c2c(c(=O)c3c(cc(cc3o2)O)O)O[C@@]4([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(CO)O4)O)O)O
InChI
InChIKey=CQLRUIIRRZYHHS-LFXZADKFSA-N
InChI=1S/C22H22O12/c1-31-12-4-8(2-3-10(12)25)20-21(17(28)15-11(26)5-9(24)6-13(15)32-20)34-22-19(30)18(29)16(27)14(7-23)33-22/h2-6,14,16,18-19,22-27,29-30H,7H2,1H3/t14-,16-,18+,19-,22+/m1/s1
Molecular Formula | C22H22O12 |
Molecular Weight | 478.4037 |
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 Jun 26 14:48:46 UTC 2021
by
admin
on
Sat Jun 26 14:48:46 UTC 2021
|
Record UNII |
BI252A6EPL
|
Record Status |
Validated (UNII)
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Record Version |
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-
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5041-82-7
Created by
admin on Sat Jun 26 14:48:46 UTC 2021 , Edited by admin on Sat Jun 26 14:48:46 UTC 2021
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PRIMARY | |||
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1085711-35-8
Created by
admin on Sat Jun 26 14:48:46 UTC 2021 , Edited by admin on Sat Jun 26 14:48:46 UTC 2021
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NON-SPECIFIC STEREOCHEMISTRY | |||
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5318645
Created by
admin on Sat Jun 26 14:48:46 UTC 2021 , Edited by admin on Sat Jun 26 14:48:46 UTC 2021
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BI252A6EPL
Created by
admin on Sat Jun 26 14:48:46 UTC 2021 , Edited by admin on Sat Jun 26 14:48:46 UTC 2021
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> CONSTITUENT ALWAYS PRESENT |