General Information of the Compound
| Compound ID |
CP0388435
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| Compound Name |
(4S,5R,6R)-5-acetamido-6-((1S,2S)-1,2-dihydroxy-3-pentanamidopropyl)-4-hydroxy-5,6-dihydro-4H-pyran-2-carboxylic acid
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| Structure |
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| Formula |
C16H26N2O8
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| Molecular Weight |
374.39
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| Canonical SMILES |
CCCCC(=O)NC[C@H](O)[C@H](O)[C@@H]1OC(=C[C@H](O)[C@H]1NC(C)=O)C(O)=O
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| InChI |
InChI=1S/C16H26N2O8/c1-3-4-5-12(22)17-7-10(21)14(23)15-13(18-8(2)19)9(20)6-11(26-15)16(24)25/h6,9-10,13-15,20-21,23H,3-5,7H2,1-2H3,(H,17,22)(H,18,19)(H,24,25)/t9-,10-,13+,14-,15+/m0/s1
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| InChIKey |
XVGFMAMZJCDOSQ-MHCWDXNASA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound