
 CHEMBL14286

 59 59  0  0  0  0  0  0  0  0999 V2000
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    7.1037    4.3861   -2.9531 H   0  0  0  0  0
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    8.0794    2.7282    0.9076 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL14286

>  <PubChem CID>
44269464

>  <Formula>
C19H35NO4

>  <Molecular Weight>
341.492000

>  <IUPAC Name>
7-[(2R)-2-(3-hydroxyoctyl)-5-oxopyrrolidin-1-yl]heptanoic acid

>  <XlogP>
3.4

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCCCCC(CCC1CCC(=O)N1CCCCCCC(=O)O)O

>  <Isomeric SMILES>
CCCCCC(CC[C@@H]1CCC(=O)N1CCCCCCC(=O)O)O

>  <InChI Std. ID>
InChI=1S/C19H35NO4/c1-2-3-6-9-17(21)13-11-16-12-14-18(22)20(16)15-8-5-4-7-10-19(23)24/h16-17,21H,2-15H2,1H3,(H,23,24)/t16-,17?/m1/s1

>  <InChI Key>
CBWGHEDGUILASE-TZHYSIJRSA-N

