Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BLG5D0
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| Binder Name |
(2S)-2-[[(2S)-3-[(2R,3R,4R,5S,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]pentanoyl]amino]-3-phenylpropanoyl]amino]propanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
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| Synonyms |
CHEMBL3633454; BDBM50131497
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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 |
C37H61N13O13
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| Canonical SMILES |
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCC(=O)N)N)CO)O)O
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| InChI |
1S/C37H61N13O13/c1-18(52)46-27-29(55)28(54)25(16-51)63-35(27)62-17-24(33(59)48-22(34(60)61)10-6-14-45-37(42)43)50-32(58)23(15-19-7-3-2-4-8-19)49-31(57)21(9-5-13-44-36(40)41)47-30(56)20(38)11-12-26(39)53/h2-4,7-8,20-25,27-29,35,51,54-55H,5-6,9-17,38H2,1H3,(H2,39,53)(H,46,52)(H,47,56)(H,48,59)(H,49,57)(H,50,58)(H,60,61)(H4,40,41,44)(H4,42,43,45)/t20-,21-,22-,23-,24-,25+,27+,28+,29+,35+/m0/s1
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| InChIKey |
JDHTWBCWXCCGJS-UIKBPVRQSA-N
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| PubChem Compound ID | ||||
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