Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H33N3O5S.ClH |
| Molecular Weight | 476.03 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2N=CN3CCCCCC3)C(=O)OCOC(=O)C(C)(C)C
InChI
InChIKey=UHPXMYLONAGUPC-YKBWBZKYSA-N
InChI=1S/C21H33N3O5S.ClH/c1-20(2,3)19(27)29-13-28-18(26)15-21(4,5)30-17-14(16(25)24(15)17)22-12-23-10-8-6-7-9-11-23;/h12,14-15,17H,6-11,13H2,1-5H3;1H/b22-12+;/t14-,15+,17-;/m1./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 | C21H33N3O5S |
| Molecular Weight | 439.569 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:26:08 UTC 2023
by
admin
on
Fri Dec 15 15:26:08 UTC 2023
|
| Record UNII |
48FX7N21H2
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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SUB03884MIG
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102745
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51213
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CHEMBL1650818
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m1654
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48FX7N21H2
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251-278-7
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DTXSID1045453
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100000091362
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115162
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