Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BJR71S
|
|||
| Binder Name |
(4S)-5-[[(2S)-1-Amino-1-oxopent-4-yn-2-yl]amino]-4-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azido-2-phenylacetyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-carboxypropanoyl]amino]-4-carboxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoic acid
|
|||
| Synonyms |
CHEMBL2372113
Click to Show/Hide
|
|||
| Binder Type |
Small molecular drug
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C47H59N11O15
|
|||
| Canonical SMILES |
CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC#C)C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C3=CC=CC=C3)N=[N+]=[N-]
|
|||
| InChI |
1S/C47H59N11O15/c1-4-9-29(40(48)66)50-41(67)30(17-19-36(60)61)51-42(68)32(22-25(2)3)54-45(71)35-12-8-21-58(35)47(73)31(18-20-37(62)63)52-44(70)34(24-38(64)65)53-43(69)33(23-26-13-15-28(59)16-14-26)55-46(72)39(56-57-49)27-10-6-5-7-11-27/h1,5-7,10-11,13-16,25,29-35,39,59H,8-9,12,17-24H2,2-3H3,(H2,48,66)(H,50,67)(H,51,68)(H,52,70)(H,53,69)(H,54,71)(H,55,72)(H,60,61)(H,62,63)(H,64,65)/t29-,30-,31-,32-,33-,34-,35-,39-/m0/s1
|
|||
| InChIKey |
CKNKIOGMUNBKNH-FRHXTIEESA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.