Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B8VN5L
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| Binder Name |
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-hydroxypropanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
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| Synonyms |
CHEMBL2336577
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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 |
C57H87N15O17
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| Canonical SMILES |
C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)N
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| InChI |
1S/C57H87N15O17/c1-28(2)22-39(67-46(78)31(6)64-49(81)37(58)26-73)50(82)65-32(7)47(79)69-41(24-34-14-18-36(76)19-15-34)55(87)72-21-9-11-43(72)53(85)62-25-44(77)63-30(5)48(80)71-45(29(3)4)54(86)70-42(27-74)52(84)68-40(23-33-12-16-35(75)17-13-33)51(83)66-38(56(88)89)10-8-20-61-57(59)60/h12-19,28-32,37-43,45,73-76H,8-11,20-27,58H2,1-7H3,(H,62,85)(H,63,77)(H,64,81)(H,65,82)(H,66,83)(H,67,78)(H,68,84)(H,69,79)(H,70,86)(H,71,80)(H,88,89)(H4,59,60,61)/t30-,31-,32-,37-,38-,39-,40-,41-,42-,43-,45-/m0/s1
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| InChIKey |
YUOOYSZZFRIQTF-UYPGKTKXSA-N
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| PubChem Compound ID | ||||
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