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3-[(E)-12-methoxynonadec-9-enoyl]oxy-4-oxidanylidene-pentanoic acid

3-[(E)-12-methoxynonadec-9-enoyl]oxy-4-oxidanylidene-pentanoic acid

Systemtic Name:3-[(E)-12-methoxynonadec-9-enoyl]oxy-4-oxidanylidene-pentanoic acid
Openeye Name:3-[(E)-12-methoxynonadec-9-enoyl]oxy-4-oxo-pentanoic acid
CAS Name:3-[(E)-12-methoxy-1-oxononadec-9-enoxy]-4-oxopentanoic acid
IUPAC Name:3-[(E)-12-methoxynonadec-9-enoyl]oxy-4-oxopentanoic acid
Traditional Name:4-keto-3-[(E)-12-methoxynonadec-9-enoyl]oxy-valeric acid
Formula: C25H44O6
MolecularWeight: 440.61326
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC=CCCCCCCCC(=O)OC(CC(=O)O)C(=O)C)OC


Isomeric SMILES

CCCCCCCC(C/C=C/CCCCCCCC(=O)OC(CC(=O)O)C(=O)C)OC


InChI

InChI=1S/C25H44O6/c1-4-5-6-11-14-17-22(30-3)18-15-12-9-7-8-10-13-16-19-25(29)31-23(21(2)26)20-24(27)28/h12,15,22-23H,4-11,13-14,16-20H2,1-3H3,(H,27,28)/b15-12+


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