[(E)-1,2-bis(oxidanyl)-3-oxidanylidene-2-(2-oxidanylideneheptadecyl)icos-11-enoxy]-N-(2-hydroxyethyl)phosphonamidic acid

Systemtic Name: [(E)-1,2-bis(oxidanyl)-3-oxidanylidene-2-(2-oxidanylideneheptadecyl)icos-11-enoxy]-N-(2-hydroxyethyl)phosphonamidic acid Openeye Name: [(E)-1,2-dihydroxy-3-oxo-2-(2-oxoheptadecyl)icos-11-enoxy]-N-(2-hydroxyethyl)phosphonamidic acid CAS Name: [(E)-1,2-dihydroxy-3-oxo-2-(2-oxoheptadecyl)eicos-11-enoxy]-N-(2-hydroxyethyl)phosphonamidic acid IUPAC Name: [(E)-1,2-dihydroxy-3-oxo-2-(2-oxoheptadecyl)icos-11-enoxy]-N-(2-hydroxyethyl)phosphonamidic acid Traditional Name: [(E)-1,2-dihydroxy-3-keto-2-(2-ketoheptadecyl)eicos-11-enoxy]-N-(2-hydroxyethyl)phosphonamidic acid Formula: C39H76NO8P MolecularWeight: 717.996401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)CC(C(O)OP(=O)(NCCO)O)(C(=O)CCCCCCCC=CCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)CC(C(O)OP(=O)(NCCO)O)(C(=O)CCCCCCC/C=C/CCCCCCCC)O

InChI

InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(43)39(45,38(44)48-49(46,47)40-33-34-41)35-36(42)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,38,41,44-45H,3-16,19-35H2,1-2H3,(H2,40,46,47)/b18-17+