Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BD4UT6
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| Binder Name |
2-[(3S,6S,9R,12R,15R)-6-(1H-Indol-3-ylmethyl)-9-(2-methylpropyl)-2,5,8,11,14-pentaoxo-12-thiophen-2-yl-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-3-yl]acetic acid
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| Synonyms |
CHEMBL414165; BDBM50029353
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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 |
C32H38N6O7S
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| Canonical SMILES |
CC(C)C[C@@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N2CCC[C@@H]2C(=O)N[C@H](C(=O)N1)C3=CC=CS3)CC(=O)O)CC4=CNC5=CC=CC=C54
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| InChI |
1S/C32H38N6O7S/c1-17(2)13-21-28(41)34-22(14-18-16-33-20-8-4-3-7-19(18)20)29(42)36-23(15-26(39)40)32(45)38-11-5-9-24(38)30(43)37-27(31(44)35-21)25-10-6-12-46-25/h3-4,6-8,10,12,16-17,21-24,27,33H,5,9,11,13-15H2,1-2H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t21-,22+,23+,24-,27+/m1/s1
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| InChIKey |
KXUDUVUGZWJNHV-PFGYYQCGSA-N
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| PubChem Compound ID | ||||
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