Binder Information
Binder General Information | Top | |||
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Binder ID |
B7PTQ3
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Binder Name |
2-[(4R)-4-[(2S,12R,18R)-12-Hydroxy-6-[(3-{[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]oxy}phenyl)methyl]-2,18-dimethyl-6,7-diazapentacyclo[11.7.0.0^{2,10}.0^{4,8}.0^{14,18}]icosa-4,7-dien-17-yl]pentanamido]acetic acid
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Synonyms |
CHEMBL362668; BDBM50157080
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C48H59N3O7
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Canonical SMILES |
C[C@H](CCC(=O)NCC(=O)O)C1CCC2[C@@]1(CCC3C2[C@@H](CC4[C@@]3(CC5=CN(N=C5C4)CC6=CC(=CC=C6)OC(=O)[C@@H](C)C7=CC8=C(C=C7)C=C(C=C8)OC)C)O)C
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InChI |
1S/C48H59N3O7/c1-28(9-16-43(53)49-25-44(54)55)38-14-15-39-45-40(17-18-47(38,39)3)48(4)24-34-27-51(50-41(34)22-35(48)23-42(45)52)26-30-7-6-8-37(19-30)58-46(56)29(2)31-10-11-33-21-36(57-5)13-12-32(33)20-31/h6-8,10-13,19-21,27-29,35,38-40,42,45,52H,9,14-18,22-26H2,1-5H3,(H,49,53)(H,54,55)/t28-,29+,35?,38?,39?,40?,42-,45?,47-,48+/m1/s1
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InChIKey |
IUSPIGYVZNHOPO-GJNDPOQKSA-N
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PubChem Compound ID |
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