Binder Information
Binder General Information | Top | |||
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Binder ID |
BVW2H4
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Binder Name |
Ac-Lys(N-epsilon-biotinoyl)-Ala-Ala-Nal-Thr(PO3H2)-Pro-Cha-Gln-NH2
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Synonyms |
CHEMBL218960; BDBM50184839
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C60H90N13O16PS
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Canonical SMILES |
C[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CCC(=O)N)C(=O)N)NC(=O)[C@H](CC3=CC4=CC=CC=C4C=C3)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCNC(=O)CCCC[C@H]5[C@@H]6[C@H](CS5)NC(=O)N6)NC(=O)C)OP(=O)(O)O
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InChI |
1S/C60H90N13O16PS/c1-33(65-55(80)42(66-36(4)74)19-12-13-27-63-49(76)22-11-10-21-47-51-45(32-91-47)70-60(85)72-51)53(78)64-34(2)54(79)68-44(31-38-23-24-39-17-8-9-18-40(39)29-38)57(82)71-50(35(3)89-90(86,87)88)59(84)73-28-14-20-46(73)58(83)69-43(30-37-15-6-5-7-16-37)56(81)67-41(52(62)77)25-26-48(61)75/h8-9,17-18,23-24,29,33-35,37,41-47,50-51H,5-7,10-16,19-22,25-28,30-32H2,1-4H3,(H2,61,75)(H2,62,77)(H,63,76)(H,64,78)(H,65,80)(H,66,74)(H,67,81)(H,68,79)(H,69,83)(H,71,82)(H2,70,72,85)(H2,86,87,88)/t33-,34-,35-,41-,42-,43-,44-,45-,46-,47-,50-,51-/m0/s1
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InChIKey |
DZRJDUPGBGLRKA-YONQOZNXSA-N
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PubChem Compound ID |
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