Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 3C22H19O13.Al |
| Molecular Weight | 1501.1169 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 15 / 15 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Al+3].[H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2=C(O)C(O)=C3C(=O)C4=C(C(=O)C3=C2O)C(C)=C(C([O-])=O)C(O)=C4.[H][C@]5(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C6=C(O)C(O)=C7C(=O)C8=C(C(=O)C7=C6O)C(C)=C(C([O-])=O)C(O)=C8.[H][C@]9(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)C%10=C(O)C(O)=C%11C(=O)C%12=C(C(=O)C%11=C%10O)C(C)=C(C([O-])=O)C(O)=C%12
InChI
InChIKey=WJOVCPOLRUPGKC-CUOMLKGQSA-K
InChI=1S/3C22H20O13.Al/c3*1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21;/h3*2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34);/q;;;+3/p-3/t3*7-,14-,19+,20-,21+;/m111./s1
| Molecular Formula | Al |
| Molecular Weight | 26.9815 |
| Charge | 3 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C22H19O13 |
| Molecular Weight | 491.3785 |
| Charge | -1 |
| 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 Dec 16 20:06:41 GMT 2023
by
admin
on
Sat Dec 16 20:06:41 GMT 2023
|
| Record UNII |
AQ8Y7GFM2W
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| Record Status |
Validated (UNII)
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| Record Version |
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AQ8Y7GFM2W
Created by
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7061-55-4
Created by
admin on Sat Dec 16 20:06:41 GMT 2023 , Edited by admin on Sat Dec 16 20:06:41 GMT 2023
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