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1-[[(9E,12E)-octadeca-9,12-dienoyl]amino]propyl dihydrogen phosphate

1-[[(9E,12E)-octadeca-9,12-dienoyl]amino]propyl dihydrogen phosphate

Systemtic Name:1-[[(9E,12E)-octadeca-9,12-dienoyl]amino]propyl dihydrogen phosphate
Openeye Name:1-[[(9E,12E)-octadeca-9,12-dienoyl]amino]propyl dihydrogen phosphate
CAS Name:1-[[(9E,12E)-1-oxooctadeca-9,12-dienyl]amino]propyl dihydrogen phosphate
IUPAC Name:1-[[(9E,12E)-octadeca-9,12-dienoyl]amino]propyl dihydrogen phosphate
Traditional Name:1-[[(9E,12E)-octadeca-9,12-dienoyl]amino]propyl dihydrogen phosphate
Formula: C21H40NO5P
MolecularWeight: 417.519761
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)NC(CC)OP(=O)(O)O


Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(=O)NC(CC)OP(=O)(O)O


InChI

InChI=1S/C21H40NO5P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(23)22-21(4-2)27-28(24,25)26/h8-9,11-12,21H,3-7,10,13-19H2,1-2H3,(H,22,23)(H2,24,25,26)/b9-8+,12-11+


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