Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BK9N5U
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| Binder Name |
Grassystatin C
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| Synonyms |
CHEMBL569445; BDBM50302108
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| Binder Type |
Small molecular drug
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| Structure |
 |
Download2D MOL
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| Formula |
C50H82N8O12
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| Canonical SMILES |
CC[C@H](C)[C@@H](C(=O)NCC(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H]([C@@H](C)CC)O)O
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| InChI |
1S/C50H82N8O12/c1-12-31(7)43(46(65)52-28-42(62)56(9)38(26-33-18-15-14-16-19-33)49(68)58-23-17-20-37(58)50(69)70-11)55-41(61)27-39(59)34(24-29(3)4)53-45(64)36(21-22-40(51)60)57(10)48(67)35(25-30(5)6)54-47(66)44(63)32(8)13-2/h14-16,18-19,29-32,34-39,43-44,59,63H,12-13,17,20-28H2,1-11H3,(H2,51,60)(H,52,65)(H,53,64)(H,54,66)(H,55,61)/t31-,32-,34-,35-,36-,37-,38+,39-,43-,44+/m0/s1
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| InChIKey |
CRTPOZWNLFMWPB-YQGVOMCUSA-N
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| PubChem Compound ID | ||||
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