Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H30Cl2N10.2C6H12O7 |
Molecular Weight | 897.757 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 8 / 8 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=O.OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=O.ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1
InChI
InChIKey=YZIYKJHYYHPJIB-UUPCJSQJSA-N
InChI=1S/C22H30Cl2N10.2C6H12O7/c23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18;2*7-1-2(8)3(9)4(10)5(11)6(12)13/h5-12H,1-4,13-14H2,(H5,25,27,29,31,33)(H5,26,28,30,32,34);2*2-5,7-11H,1H2,(H,12,13)/t;2*2-,3-,4+,5-/m.11/s1
Molecular Formula | C6H12O7 |
Molecular Weight | 196.1553 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C22H30Cl2N10 |
Molecular Weight | 505.447 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:02:12 UTC 2023
by
admin
on
Fri Dec 15 15:02:12 UTC 2023
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Record UNII |
MOR84MUD8E
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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EPA PESTICIDE CODE |
45504
Created by
admin on Fri Dec 15 15:02:12 UTC 2023 , Edited by admin on Fri Dec 15 15:02:12 UTC 2023
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FDA ORPHAN DRUG |
13086
Created by
admin on Fri Dec 15 15:02:12 UTC 2023 , Edited by admin on Fri Dec 15 15:02:12 UTC 2023
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NCI_THESAURUS |
C28394
Created by
admin on Fri Dec 15 15:02:12 UTC 2023 , Edited by admin on Fri Dec 15 15:02:12 UTC 2023
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Code System | Code | Type | Description | ||
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DTXSID5034519
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DBSALT000023
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242-354-0
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MOR84MUD8E
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m3362
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29089
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SUB01215MIG
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28312
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20791
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18472-51-0
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C47974
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100000091036
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753971
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MOR84MUD8E
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C010882
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CHEMBL790
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SUB11810MIG
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