Binder Information
Binder General Information | Top | |||
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Binder ID |
B8D6QH
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Binder Name |
(4S)-5-[[(2S,3R)-1-[[(2S)-1-[[(1S)-1-Carboxy-2-methylpropyl]amino]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxo-4-(4-pyren-1-ylbutylamino)pentanoic acid
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Synonyms |
CHEMBL1688626; BDBM50339562
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C37H46N4O8
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Canonical SMILES |
C[C@H]([C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)O)NCCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1)O
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InChI |
1S/C37H46N4O8/c1-20(2)32(37(48)49)40-34(45)21(3)39-36(47)33(22(4)42)41-35(46)28(17-18-29(43)44)38-19-6-5-8-23-11-12-26-14-13-24-9-7-10-25-15-16-27(23)31(26)30(24)25/h7,9-16,20-22,28,32-33,38,42H,5-6,8,17-19H2,1-4H3,(H,39,47)(H,40,45)(H,41,46)(H,43,44)(H,48,49)/t21-,22+,28-,32-,33-/m0/s1
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InChIKey |
JKZSRFKLNYPPDJ-HUUSFFTHSA-N
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PubChem Compound ID |
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