Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LE9AK6
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| Ligand Name |
25-chloro-11-(ethylsulfonyl)-44-morpholino-11H-5,12-dioxa-3-aza-1(3,6)-indola-2(4,2)-pyrimidina-4(1,3)-benzenacyclododecaphane
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| Synonyms |
25-chloro-11-(ethylsulfonyl)-44-morpholino-11H-5,12-dioxa-3-aza-1(3,6)-indola-2(4,2)-pyrimidina-4(1,3)-benzenacyclododecaphane
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| Structure |
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Download2D MOL |
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| Formula |
C30H34ClN5O5S
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| Canonical SMILES |
CCS(=O)(=O)N1C=C2C3=C1C=C(C=C3)OCCCCCCOC4=C(C=CC(=C4)NC5=NC=C(C2=N5)Cl)N6CCOCC6
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| InChI |
1S/C30H34ClN5O5S/c1-2-42(37,38)36-20-24-23-9-8-22(18-27(23)36)40-13-5-3-4-6-14-41-28-17-21(33-30-32-19-25(31)29(24)34-30)7-10-26(28)35-11-15-39-16-12-35/h7-10,17-20H,2-6,11-16H2,1H3,(H,32,33,34)
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| InChIKey |
KBYYUDNRZUURRS-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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