Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B9WG1K
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| Binder Name |
(3S,6S,9R,10R,11S,12S,13E,15E,18S)-18-((2E,4E)-6-(1,2-Oxazinan-2-yl)-6-oxohexa-2,4-dien-2-yl)-3-(3-fluoro-5-hydroxybenzyl)-10,12-dihydroxy-6-isopropyl-11-methyl-9-(3-oxobutyl)-19-oxa-1,4,7,25-tetraazabicyclo[19.3.1]pentacosa-13,15-diene-2,5,8,20-tetraone
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| Synonyms |
NVP018; CHEMBL3704747; SCHEMBL12958865; BDBM172717; US9090657, 24
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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 |
C45H62FN5O11
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| Canonical SMILES |
C[C@H]1[C@H](/C=C/C=C/C[C@H](OC(=O)C2CCCN(N2)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([C@@H]1O)CCC(=O)C)C(C)C)CC3=CC(=CC(=C3)F)O)/C(=C/C=C/C(=O)N4CCCCO4)/C)O
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| InChI |
1S/C45H62FN5O11/c1-27(2)40-43(58)47-36(25-31-23-32(46)26-33(53)24-31)44(59)50-20-12-14-35(49-50)45(60)62-38(28(3)13-11-17-39(55)51-21-9-10-22-61-51)16-8-6-7-15-37(54)30(5)41(56)34(42(57)48-40)19-18-29(4)52/h6-8,11,13,15,17,23-24,26-27,30,34-38,40-41,49,53-54,56H,9-10,12,14,16,18-22,25H2,1-5H3,(H,47,58)(H,48,57)/b8-6+,15-7+,17-11+,28-13+/t30-,34+,35?,36-,37-,38-,40-,41+/m0/s1
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| InChIKey |
CFLBTKFHBBDVKC-RROFBZPUSA-N
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| PubChem Compound ID | ||||
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