General Information of the Compound
| Compound ID |
CP0524914
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| Compound Name |
(2S)-2-[[(2R)-2-amino-3-[(2R)-2,3-di(tetradecanoyloxy)propyl]sulfanylpropanoyl]amino]-3-hydroxypropanoic acid
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| Structure |
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| Formula |
C37H70N2O8S
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| Molecular Weight |
703.04
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| Canonical SMILES |
CCCCCCCCCCCCCC(=O)OC[C@H](CSC[C@H](N)C(=O)N[C@@H](CO)C(O)=O)OC(=O)CCCCCCCCCCCCC
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| InChI |
InChI=1S/C37H70N2O8S/c1-3-5-7-9-11-13-15-17-19-21-23-25-34(41)46-28-31(29-48-30-32(38)36(43)39-33(27-40)37(44)45)47-35(42)26-24-22-20-18-16-14-12-10-8-6-4-2/h31-33,40H,3-30,38H2,1-2H3,(H,39,43)(H,44,45)/t31-,32+,33+/m1/s1
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| InChIKey |
ZWXWXCXNGRNHTA-CEUYOYMZSA-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