Binder Information
Binder General Information | Top | |||
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Binder ID |
B6UO1Y
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Binder Name |
2-[(3S,6R,11R,14S,17S,23S,26S)-6-Amino-11-[(2-amino-2-oxoethyl)carbamoyl]-23-(3-amino-3-oxopropyl)-14-[(1R)-1-hydroxyethyl]-3-(1H-imidazol-5-ylmethyl)-2,5,13,16,19,22,25-heptaoxo-8,9-dithia-1,4,12,15,18,21,24-heptazabicyclo[24.3.0]nonacosan-17-yl]acetic acid
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Synonyms |
CHEMBL1950041; BDBM50363996
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C34H51N13O13S2
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Canonical SMILES |
C[C@H]([C@H]1C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1)CC(=O)O)CCC(=O)N)CC3=CN=CN3)N)C(=O)NCC(=O)N)O
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InChI |
1S/C34H51N13O13S2/c1-15(48)27-33(59)45-21(30(56)39-10-24(37)50)13-62-61-12-17(35)28(54)44-20(7-16-9-38-14-41-16)34(60)47-6-2-3-22(47)32(58)43-18(4-5-23(36)49)29(55)40-11-25(51)42-19(8-26(52)53)31(57)46-27/h9,14-15,17-22,27,48H,2-8,10-13,35H2,1H3,(H2,36,49)(H2,37,50)(H,38,41)(H,39,56)(H,40,55)(H,42,51)(H,43,58)(H,44,54)(H,45,59)(H,46,57)(H,52,53)/t15-,17+,18+,19+,20+,21+,22+,27+/m1/s1
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InChIKey |
YHSYEUTZDOVDQP-RQMIKUMQSA-N
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PubChem Compound ID |
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