Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C43H67FN2O4S.2ClH |
| Molecular Weight | 799.988 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 10 / 10 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.[H][C@]12[C@@H](CC[C@@]1(CC[C@]3(C)[C@]2([H])CC[C@]4([H])[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@]5([H])CC[C@@]34C)NCCN7CCS(=O)(=O)CC7)C(C)=C
InChI
InChIKey=XCKBDEJKCRIISZ-RXNWYHASSA-N
InChI=1S/C43H67FN2O4S.2ClH/c1-29(2)31-12-19-43(45-22-23-46-24-26-51(49,50)27-25-46)21-20-40(6)33(36(31)43)8-9-35-39(5)15-13-32(38(3,4)34(39)14-16-41(35,40)7)30-10-17-42(28-44,18-11-30)37(47)48;;/h10,13,31,33-36,45H,1,8-9,11-12,14-28H2,2-7H3,(H,47,48);2*1H/t31-,33+,34-,35+,36+,39-,40+,41+,42+,43-;;/m0../s1
| 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 |
| Molecular Formula | C43H67FN2O4S |
| Molecular Weight | 727.066 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 10 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:37:16 GMT 2023
by
admin
on
Sat Dec 16 14:37:16 GMT 2023
|
| Record UNII |
TQJ6EYI8Q0
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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2442512-14-1
Created by
admin on Sat Dec 16 14:37:16 GMT 2023 , Edited by admin on Sat Dec 16 14:37:16 GMT 2023
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162623728
Created by
admin on Sat Dec 16 14:37:16 GMT 2023 , Edited by admin on Sat Dec 16 14:37:16 GMT 2023
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PRIMARY | |||
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TQJ6EYI8Q0
Created by
admin on Sat Dec 16 14:37:16 GMT 2023 , Edited by admin on Sat Dec 16 14:37:16 GMT 2023
|
PRIMARY |
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |
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