Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B9TE2I
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| Binder Name |
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-Amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-5-oxopentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
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| Synonyms |
CHEMBL2029398; BDBM50382925
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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 |
C38H57N13O9
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| Canonical SMILES |
C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)N
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| InChI |
1S/C38H57N13O9/c39-24(19-22-9-3-1-4-10-22)31(54)47-26(15-16-30(40)53)33(56)48-25(13-7-17-45-37(41)42)32(55)50-28(20-23-11-5-2-6-12-23)34(57)51-29(21-52)35(58)49-27(36(59)60)14-8-18-46-38(43)44/h1-6,9-12,24-29,52H,7-8,13-21,39H2,(H2,40,53)(H,47,54)(H,48,56)(H,49,58)(H,50,55)(H,51,57)(H,59,60)(H4,41,42,45)(H4,43,44,46)/t24-,25-,26-,27-,28-,29-/m0/s1
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| InChIKey |
MACXHQKZDHBQTA-AQRCPPRCSA-N
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| PubChem Compound ID | ||||
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