Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H36N2O4.C4H4O4 |
Molecular Weight | 508.6044 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CC(C)(N)CNC(=O)C[C@H]1CC[C@]2(CC1)OOC3(O2)C4CC5CC(C4)CC3C5
InChI
InChIKey=SVDSPJJUJMMDFX-CXCXETQFSA-N
InChI=1S/C22H36N2O4.C4H4O4/c1-20(2,23)13-24-19(25)12-14-3-5-21(6-4-14)26-22(28-27-21)17-8-15-7-16(10-17)11-18(22)9-15;5-3(6)1-2-4(7)8/h14-18H,3-13,23H2,1-2H3,(H,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-,15?,16?,17?,18?,21+,22?;
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | C22H36N2O4 |
Molecular Weight | 392.5322 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:04:37 UTC 2023
by
admin
on
Sat Dec 16 15:04:37 UTC 2023
|
Record UNII |
1C86ZU1OEN
|
Record Status |
Validated (UNII)
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Record Version |
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-
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959520-73-1
Created by
admin on Sat Dec 16 15:04:37 UTC 2023 , Edited by admin on Sat Dec 16 15:04:37 UTC 2023
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1C86ZU1OEN
Created by
admin on Sat Dec 16 15:04:37 UTC 2023 , Edited by admin on Sat Dec 16 15:04:37 UTC 2023
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300000039291
Created by
admin on Sat Dec 16 15:04:37 UTC 2023 , Edited by admin on Sat Dec 16 15:04:37 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |