Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BZ9EC2
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| Binder Name |
(3S)-3-[[(2S)-2-Acetamido-3-methylbutanoyl]amino]-4-[[(2S)-1-[1-[[(3S)-2-hydroxy-5-oxooxolan-3-yl]carbamoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid
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| Synonyms |
CHEMBL1835400; BDBM50355104
Click to Show/Hide
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL
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| Formula |
C32H45N5O12
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| Canonical SMILES |
CC(C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC2=CC(=C(C=C2C1C(=O)N[C@H]3CC(=O)OC3O)OC)OC)NC(=O)C
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| InChI |
1S/C32H45N5O12/c1-14(2)25(33-16(5)38)29(43)34-19(12-23(39)40)28(42)36-26(15(3)4)31(45)37-9-8-17-10-21(47-6)22(48-7)11-18(17)27(37)30(44)35-20-13-24(41)49-32(20)46/h10-11,14-15,19-20,25-27,32,46H,8-9,12-13H2,1-7H3,(H,33,38)(H,34,43)(H,35,44)(H,36,42)(H,39,40)/t19-,20-,25-,26-,27?,32?/m0/s1
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| InChIKey |
DPUPNCRWGQWHAO-VJXRXTMISA-N
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| PubChem Compound ID | ||||
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