Details
Stereochemistry | EPIMERIC |
Molecular Formula | C47H90NO12.Cl |
Molecular Weight | 896.67 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 11 |
E/Z Centers | 2 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].CCCCCCCCCCCC[N+](C)(C)CC(O)COC[C@H]1O[C@H](OC[C@H]2O[C@@H](OCCCCCCCC\C=C/C\C=C/CCCCC)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChI
InChIKey=OGFGLBWSOTYVKZ-PXGIPKTPSA-M
InChI=1S/C47H90NO12.ClH/c1-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-57-46-44(54)43(53)41(51)39(60-46)36-58-47-45(55)42(52)40(50)38(59-47)35-56-34-37(49)33-48(3,4)31-29-27-25-23-16-14-12-10-8-6-2;/h13,15,18-19,37-47,49-55H,5-12,14,16-17,20-36H2,1-4H3;1H/q+1;/p-1/b15-13-,19-18-;/t37?,38-,39-,40-,41-,42+,43+,44-,45-,46-,47+;/m1./s1
Molecular Formula | C47H89NO12 |
Molecular Weight | 860.2091 |
Charge | 0 |
Count |
|
Stereochemistry | MIXED |
Additional Stereochemistry | No |
Defined Stereocenters | 10 / 11 |
E/Z Centers | 2 |
Optical Activity | UNSPECIFIED |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
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 11:16:34 GMT 2023
by
admin
on
Sat Dec 16 11:16:34 GMT 2023
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Record UNII |
BPD64QY22F
|
Record Status |
Validated (UNII)
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Record Version |
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-
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139033010
Created by
admin on Sat Dec 16 11:16:34 GMT 2023 , Edited by admin on Sat Dec 16 11:16:34 GMT 2023
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PRIMARY | |||
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BPD64QY22F
Created by
admin on Sat Dec 16 11:16:34 GMT 2023 , Edited by admin on Sat Dec 16 11:16:34 GMT 2023
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PRIMARY |