Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L5RHY0
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| Ligand Name |
(Z)-10-hydroxy-10-[hydroxy-[(5S)-6-[(2S)-4-hydroxy-4-[[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino]butan-2-yl]oxy-5-[[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-oxazole-4-carbonyl]amino]-6-oxohexyl]amino]dec-8-enoic acid;iron
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| Synonyms |
CARBOXYMYCOBACTIN S
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| Structure |
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Download2D MOL
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| Formula |
C36H55FeN5O12
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| Canonical SMILES |
CC(CC(NC1CCCCN(C1=O)O)O)OC(=O)C(CCCCN(C(C=CCCCCCCC(=O)O)O)O)NC(=O)C2COC(=N2)C3=CC=CC=C3O.[Fe]
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| InChI |
1S/C36H55N5O12.Fe/c1-24(22-30(43)37-26-15-10-13-21-41(51)35(26)48)53-36(49)27(38-33(47)28-23-52-34(39-28)25-14-8-9-17-29(25)42)16-11-12-20-40(50)31(44)18-6-4-2-3-5-7-19-32(45)46;/h6,8-9,14,17-18,24,26-28,30-31,37,42-44,50-51H,2-5,7,10-13,15-16,19-23H2,1H3,(H,38,47)(H,45,46);/b18-6-;/t24-,26-,27-,28-,30?,31?;/m0./s1
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| InChIKey |
FZVLHALQOBQKNV-SKAQIPKPSA-N
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| PubChem Compound ID | ||||
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