
 CID 52944193

106110  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CID 52944193

>  <PubChem CID>
52944193

>  <Formula>
C52H48O6

>  <Molecular Weight>
768.950000

>  <IUPAC Name>
(E)-3-[2-[(E)-3-(3-methyl-2-phenylmethoxyphenyl)prop-1-enyl]phenyl]prop-2-enoic acid;(E)-3-[2-[(E)-3-(3-methyl-2-phenylmethoxyphenyl)prop-2-enyl]phenyl]prop-2-enoic acid

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC1=C(C(=CC=C1)CC=CC2=CC=CC=C2C=CC(=O)O)OCC3=CC=CC=C3.CC1=CC=CC(=C1OCC2=CC=CC=C2)C=CCC3=CC=CC=C3C=CC(=O)O

>  <Isomeric SMILES>
CC1=C(C(=CC=C1)C/C=C/C2=CC=CC=C2/C=C/C(=O)O)OCC3=CC=CC=C3.CC1=CC=CC(=C1OCC2=CC=CC=C2)/C=C/CC3=CC=CC=C3/C=C/C(=O)O

>  <InChI Std. ID>
InChI=1S/2C26H24O3/c2*1-20-9-7-15-24(26(20)29-19-21-10-3-2-4-11-21)16-8-14-22-12-5-6-13-23(22)17-18-25(27)28/h2-13,15-18H,14,19H2,1H3,(H,27,28);2-15,17-18H,16,19H2,1H3,(H,27,28)/b16-8+,18-17+;14-8+,18-17+

>  <InChI Key>
AOLPNACEJPNORF-IOBCGFDPSA-N

