Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H26N2O3.C4H6O6 |
Molecular Weight | 504.5296 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.[H][C@]12N3CCC[C@@]1(CC)C[C@@](O)(N4C5=CC=CC=C5C(CC3)=C24)C(=O)OC
InChI
InChIKey=KHZGWDJDORKMJQ-OILCKBBASA-N
InChI=1S/C21H26N2O3.C4H6O6/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2;5-1(3(7)8)2(6)4(9)10/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t18-,20+,21+;1-,2-/m11/s1
Molecular Formula | C4H6O6 |
Molecular Weight | 150.0868 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C21H26N2O3 |
Molecular Weight | 354.4427 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:37:37 UTC 2023
by
admin
on
Sat Dec 16 01:37:37 UTC 2023
|
Record UNII |
27L20CUV30
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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27L20CUV30
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71300416
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SUB05100MIG
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DTXSID90981975
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C031177
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64034-84-0
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100000087900
Created by
admin on Sat Dec 16 01:37:37 UTC 2023 , Edited by admin on Sat Dec 16 01:37:37 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 |