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3-[[4-[(E)-octadec-1-enyl]phenyl]-oxidanyl-phosphoryl]propanoic acid

3-[[4-[(E)-octadec-1-enyl]phenyl]-oxidanyl-phosphoryl]propanoic acid

Systemtic Name:3-[[4-[(E)-octadec-1-enyl]phenyl]-oxidanyl-phosphoryl]propanoic acid
Openeye Name:3-[hydroxy-[4-[(E)-octadec-1-enyl]phenyl]phosphoryl]propanoic acid
CAS Name:3-[hydroxy-[4-[(E)-octadec-1-enyl]phenyl]phosphoryl]propanoic acid
IUPAC Name:3-[hydroxy-[4-[(E)-octadec-1-enyl]phenyl]phosphoryl]propanoic acid
Traditional Name:3-[hydroxy-[4-[(E)-octadec-1-enyl]phenyl]phosphoryl]propionic acid
Formula: C27H45O4P
MolecularWeight: 464.617561
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC=CC1=CC=C(C=C1)P(=O)(CCC(=O)O)O


Isomeric SMILES

CCCCCCCCCCCCCCCC/C=C/C1=CC=C(C=C1)P(=O)(CCC(=O)O)O


InChI

InChI=1S/C27H45O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-19-21-26(22-20-25)32(30,31)24-23-27(28)29/h17-22H,2-16,23-24H2,1H3,(H,28,29)(H,30,31)/b18-17+


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