Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1GO9F
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| Ligand Name |
(3~{S},6~{S},7~{S},9~{a}~{S})-~{N}-[(4-~{tert}-butylphenyl)methyl]-7-(hydroxymethyl)-6-[[(2~{S})-2-(methylamino)butanoyl]amino]-5-oxidanylidene-1,2,3,6,7,8,9,9~{a}-octahydropyrrolo[1,2-a]azepine-3-carboxamide
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| Synonyms |
(3~{S},6~{S},7~{S},9~{a}~{S})-~{N}-[(4-~{tert}-butylphenyl)methyl]-7-(hydroxymethyl)-6-[[(2~{S})-2-(methylamino)butanoyl]amino]-5-oxidanylidene-1,2,3,6,7,8,9,9~{a}-octahydropyrrolo[1,2-a]azepine-3-carboxamide; C3T
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| Structure |
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Download2D MOL |
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| Formula |
C27H42N4O4
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| Canonical SMILES |
CCC(C(=O)NC1C(CCC2CCC(N2C1=O)C(=O)NCC3=CC=C(C=C3)C(C)(C)C)CO)NC
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| InChI |
1S/C27H42N4O4/c1-6-21(28-5)24(33)30-23-18(16-32)9-12-20-13-14-22(31(20)26(23)35)25(34)29-15-17-7-10-19(11-8-17)27(2,3)4/h7-8,10-11,18,20-23,28,32H,6,9,12-16H2,1-5H3,(H,29,34)(H,30,33)/t18-,20+,21+,22+,23+/m1/s1
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| InChIKey |
NJWOUDIHXORURQ-PMAMDCHESA-N
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| PubChem Compound ID | ||||
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