Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C38H55O49S7.9Na |
Molecular Weight | 1727.177 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 25 / 25 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[H][C@]5(O[C@H]1[C@H](OC)[C@@H](OC)[C@]([H])(O[C@@H]2[C@@H](COS([O-])(=O)=O)O[C@]([H])(O[C@H]3[C@H](OC)[C@@H](OC)[C@]([H])(O[C@@H]4[C@@H](COS([O-])(=O)=O)O[C@H](OC)[C@H](OS([O-])(=O)=O)[C@H]4OS([O-])(=O)=O)O[C@H]3C([O-])=O)[C@H](OS([O-])(=O)=O)[C@H]2OS([O-])(=O)=O)O[C@@H]1C([O-])=O)O[C@H](COS([O-])(=O)=O)[C@@H](OC)[C@H](OC)[C@H]5OC
InChI
InChIKey=MVPQUSQUURLQKF-MCPDASDXSA-E
InChI=1S/C38H64O49S7.9Na/c1-64-15-12(9-72-88(43,44)45)76-35(27(68-5)18(15)65-2)80-21-19(66-3)28(69-6)37(82-25(21)32(39)40)79-17-14(11-74-90(49,50)51)77-38(31(87-94(61,62)63)24(17)85-92(55,56)57)81-22-20(67-4)29(70-7)36(83-26(22)33(41)42)78-16-13(10-73-89(46,47)48)75-34(71-8)30(86-93(58,59)60)23(16)84-91(52,53)54;;;;;;;;;/h12-31,34-38H,9-11H2,1-8H3,(H,39,40)(H,41,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63);;;;;;;;;/q;9*+1/p-9/t12-,13-,14-,15-,16-,17-,18+,19+,20+,21+,22+,23+,24+,25+,26-,27-,28-,29-,30-,31-,34+,35-,36-,37-,38-;;;;;;;;;/m1........./s1
Molecular Formula | C38H55O49S7 |
Molecular Weight | 1520.269 |
Charge | -9 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 25 / 25 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 17:26:02 UTC 2023
by
admin
on
Sat Dec 16 17:26:02 UTC 2023
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Record UNII |
H84IXP29FN
|
Record Status |
Validated (UNII)
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Record Version |
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-
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100000089431
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SUB25406
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H84IXP29FN
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8009
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149920-56-9
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admin on Sat Dec 16 17:26:02 UTC 2023 , Edited by admin on Sat Dec 16 17:26:02 UTC 2023
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m6202
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admin on Sat Dec 16 17:26:02 UTC 2023 , Edited by admin on Sat Dec 16 17:26:02 UTC 2023
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PRIMARY | Merck Index | ||
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C170051
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QQ-81
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DBSALT002010
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CHEMBL1908845
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3083444
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admin on Sat Dec 16 17:26:02 UTC 2023 , Edited by admin on Sat Dec 16 17:26:02 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |