[(Z)-20-azanyl-19-oxidanyl-18,21-bis(oxidanylidene)dotetracont-33-en-20-yl]phosphonic acid

Systemtic Name: [(Z)-20-azanyl-19-oxidanyl-18,21-bis(oxidanylidene)dotetracont-33-en-20-yl]phosphonic acid Openeye Name: [(Z)-1-amino-1-(1-hydroxy-2-oxo-nonadecyl)-2-oxo-tricos-14-enyl]phosphonic acid CAS Name: [(Z)-20-amino-19-hydroxy-18,21-dioxodotetracont-33-en-20-yl]phosphonic acid IUPAC Name: [(Z)-20-amino-19-hydroxy-18,21-dioxodotetracont-33-en-20-yl]phosphonic acid Traditional Name: [(Z)-1-amino-1-(1-hydroxy-2-keto-nonadecyl)-2-keto-tricos-14-enyl]phosphonic acid Formula: C42H82NO6P MolecularWeight: 728.077341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(C(C(=O)CCCCCCCCCCCC=CCCCCCCCC)(N)P(=O)(O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(C(C(=O)CCCCCCCCCCC/C=C\CCCCCCCC)(N)P(=O)(O)O)O

InChI

InChI=1S/C42H82NO6P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-40(45)42(43,50(47,48)49)41(46)39(44)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h17,19,41,46H,3-16,18,20-38,43H2,1-2H3,(H2,47,48,49)/b19-17-