[3-oxidanylidene-5-(2-phosphonooxydecan-2-yloxy)tridec-1-en-5-yl] dihydrogen phosphate

Systemtic Name: [3-oxidanylidene-5-(2-phosphonooxydecan-2-yloxy)tridec-1-en-5-yl] dihydrogen phosphate Openeye Name: [1-methyl-1-[1-(2-oxobut-3-enyl)-1-phosphonooxy-nonoxy]nonyl] dihydrogen phosphate CAS Name: [3-oxo-5-(2-phosphonooxydecan-2-yloxy)tridec-1-en-5-yl] dihydrogen phosphate IUPAC Name: [3-oxo-5-(2-phosphonooxydecan-2-yloxy)tridec-1-en-5-yl] dihydrogen phosphate Traditional Name: [3-keto-1-(1-methyl-1-phosphonooxy-nonoxy)-1-octyl-pent-4-enyl] dihydrogen phosphate Formula: C23H46O10P2 MolecularWeight: 544.552862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H46O10P2/c1-5-8-10-12-14-16-18-22(4,32-34(25,26)27)31-23(20-21(24)7-3,33-35(28,29)30)19-17-15-13-11-9-6-2/h7H,3,5-6,8-20H2,1-2,4H3,(H2,25,26,27)(H2,28,29,30)