sodium [3-[(E)-heptadec-8-enyl]cyclopentyl]methyl hydrogen phosphate

Systemtic Name: sodium [3-[(E)-heptadec-8-enyl]cyclopentyl]methyl hydrogen phosphate Openeye Name: sodium [3-[(E)-heptadec-8-enyl]cyclopentyl]methyl hydrogen phosphate CAS Name: sodium [3-[(E)-heptadec-8-enyl]cyclopentyl]methyl hydrogen phosphate IUPAC Name: sodium [3-[(E)-heptadec-8-enyl]cyclopentyl]methyl hydrogen phosphate Traditional Name: sodium [3-[(E)-heptadec-8-enyl]cyclopentyl]methyl hydrogen phosphate Formula: C23H44NaO4P MolecularWeight: 438.556591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC1CCC(C1)COP(=O)(O)[O-].[Na+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC1CCC(C1)COP(=O)(O)[O-].[Na+]

InChI

InChI=1S/C23H45O4P.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-18-19-23(20-22)21-27-28(24,25)26;/h9-10,22-23H,2-8,11-21H2,1H3,(H2,24,25,26);/q;+1/p-1/b10-9+;