Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4S2IO
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| Ligand Name |
cortistatin A
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| Synonyms |
cortistatin A; (+)-cortistatin A; Cortistatine A; 882976-95-6; Cortistatin A [MI]; 17-epi-Cortistatin A; 6VG04XOV89; CHEMBL4080906; (1R,2R,3S,5R)-3-(dimethylamino)-17beta-(isoquinolin-7-yl)-5,8alpha-epoxy-9,19-cyclo-9,10-secoandrosta-9(11),10-diene-1,2-diol; (3S,3aR,7R,8R,9S,10aR,12aS,12bR)-9-(Dimethylamino)-1,2,3,3a,4,7,8,9,10,11,12,12b-dodecahydro-3-(7-isoquinolinyl)-3a-methyl-10a,12a-epoxybenzo(4,5)cyclohept(1,2-E)indene-7,8-diol; 10a,12a-Epoxybenzo(4,5)cyclohept(1,2-E)indene-7,8-diol, 9-(dimethylamino)-1,2,3,3a,4,7,8,9,10,11,12,12b-dodecahydro-3-(7-isoquinolinyl)-3a-methyl-, (3S,3aR,7R,8R,9S,10aR,12aS,12bR)-; (1R,2R,3S,5R,8alpha,17beta)-3-(dimethylamino)-17-(isoquinolin-7-yl)-5,8-epoxy-9,19-cyclo-9,10-secoandrosta-9(11),10-diene-1,2-diol; (3S,3aR,7R,8R,9S,10aR,12aS,12bR)-9-(Dimethylamino)-3-(isoquinolin-7-yl)-3a-methyl-1,2,3,3a,4,7,8,9,10,11,12,12b-dodecahydro-10a,12a-epoxybenzo[4,5]cyclohepta[1,2-e]indene-7,8-diol; UNII-6VG04XOV89; GTPL9885; SCHEMBL12431713; CHEBI:67171; DTXSID10468617; BDBM50248631; Q5173335; (1S,2R,5S,6R,12R,13R,14S,16R)-14-(dimethylamino)-5-isoquinolin-7-yl-6-methyl-19-oxapentacyclo[14.2.1.01,9.02,6.011,16]nonadeca-8,10-diene-12,13-diol; C1I
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| Structure |
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Download2D MOL |
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| Formula |
C30H36N2O3
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| Canonical SMILES |
CC12CC=C3C=C4C(C(C(CC45CCC3(C1CCC2C6=CC7=C(C=C6)C=CN=C7)O5)N(C)C)O)O
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| InChI |
1S/C30H36N2O3/c1-28-10-8-21-15-23-26(33)27(34)24(32(2)3)16-29(23)11-12-30(21,35-29)25(28)7-6-22(28)19-5-4-18-9-13-31-17-20(18)14-19/h4-5,8-9,13-15,17,22,24-27,33-34H,6-7,10-12,16H2,1-3H3/t22-,24+,25-,26-,27-,28-,29-,30-/m1/s1
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| InChIKey |
KSGZCKSNTAJOJS-DZBMUNJRSA-N
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| PubChem Compound ID | ||||
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