Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H29N7O5.2ClH |
| Molecular Weight | 544.431 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.COC1=CC=C(C[C@H](N)C(=O)N[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O)N3C=NC4=C3N=CN=C4N(C)C)C=C1
InChI
InChIKey=MKSVFGKWZLUTTO-FZFAUISWSA-N
InChI=1S/C22H29N7O5.2ClH/c1-28(2)19-17-20(25-10-24-19)29(11-26-17)22-18(31)16(15(9-30)34-22)27-21(32)14(23)8-12-4-6-13(33-3)7-5-12;;/h4-7,10-11,14-16,18,22,30-31H,8-9,23H2,1-3H3,(H,27,32);2*1H/t14-,15+,16+,18+,22+;;/m0../s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C259
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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5682-30-4
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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NON-SPECIFIC STEREOCHEMISTRY | |||
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3055
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | |||
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200-387-8
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | |||
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PGN54228S5
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | |||
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58-58-2
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | |||
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DTXSID7045861
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | |||
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CHEMBL469912
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | |||
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m9324
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | Merck Index | ||
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C75148
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY | |||
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443311
Created by
admin on Fri Dec 15 16:01:53 UTC 2023 , Edited by admin on Fri Dec 15 16:01:53 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD