Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H21NO7.ClH |
| Molecular Weight | 447.866 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@@]12CC3=C(C(=O)[C@]1(O)C(=O)C(C(C)=O)=C(O)[C@@H]2N)C(O)=C4C(O)=C(C)C=CC4=C3C
InChI
InChIKey=BXIBTMOWCBKWEX-JKPGXYSKSA-N
InChI=1S/C22H21NO7.ClH/c1-7-4-5-10-8(2)11-6-12-16(23)19(27)13(9(3)24)20(28)22(12,30)21(29)15(11)18(26)14(10)17(7)25;/h4-5,12,16,25-27,30H,6,23H2,1-3H3;1H/t12-,16+,22+;/m0./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1595
Created by
admin on Fri Dec 15 15:05:38 UTC 2023 , Edited by admin on Fri Dec 15 15:05:38 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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C98041
Created by
admin on Fri Dec 15 15:05:38 UTC 2023 , Edited by admin on Fri Dec 15 15:05:38 UTC 2023
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PRIMARY | |||
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56433-46-6
Created by
admin on Fri Dec 15 15:05:38 UTC 2023 , Edited by admin on Fri Dec 15 15:05:38 UTC 2023
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PRIMARY | |||
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CHEMBL2110884
Created by
admin on Fri Dec 15 15:05:38 UTC 2023 , Edited by admin on Fri Dec 15 15:05:38 UTC 2023
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PRIMARY | |||
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535KJI966J
Created by
admin on Fri Dec 15 15:05:38 UTC 2023 , Edited by admin on Fri Dec 15 15:05:38 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD