Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LA3U7T
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| Ligand Name |
(E)-N-(2-methylpropylidene)-N~2~-{[(4S)-17-[(methylsulfonyl)(propyl)amino]-2-oxo-3-azatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-hexaen-4-yl]methyl}-D-threoninamide
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| Synonyms |
(E)-N-(2-methylpropylidene)-N~2~-{[(4S)-17-[(methylsulfonyl)(propyl)amino]-2-oxo-3-azatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-hexaen-4-yl]methyl}-D-threoninamide
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| Structure |
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Download2D MOL |
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| Formula |
C32H46N4O5S
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| Canonical SMILES |
CCCN(C1=CC2=CC(=C1)C(=O)NC(CC3=CC=CC(=C3)CCCC2)CNC(C(C)O)C(=O)N=CC(C)C)S(=O)(=O)C
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| InChI |
1S/C32H46N4O5S/c1-6-14-36(42(5,40)41)29-18-26-11-8-7-10-24-12-9-13-25(15-24)17-28(35-31(38)27(16-26)19-29)21-33-30(23(4)37)32(39)34-20-22(2)3/h9,12-13,15-16,18-20,22-23,28,30,33,37H,6-8,10-11,14,17,21H2,1-5H3,(H,35,38)/t23-,28-,30+/m0/s1
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| InChIKey |
DQMUZJCEBNKYBU-KNHXXRFOSA-N
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| PubChem Compound ID | ||||
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