(E)-2-azanyl-3,14-bis(oxidanyl)icos-6-enoic acid

Systemtic Name: (E)-2-azanyl-3,14-bis(oxidanyl)icos-6-enoic acid Openeye Name: (E)-2-amino-3,14-dihydroxy-icos-6-enoic acid CAS Name: (E)-2-amino-3,14-dihydroxy-6-eicosenoic acid IUPAC Name: (E)-2-amino-3,14-dihydroxyicos-6-enoic acid Traditional Name: (E)-2-amino-3,14-dihydroxy-eicos-6-enoic acid Formula: C20H39NO4 MolecularWeight: 357.52796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCC=CCCC(C(C(=O)O)N)O)O

Isomeric SMILES

CCCCCCC(CCCCCC/C=C/CCC(C(C(=O)O)N)O)O

InChI

InChI=1S/C20H39NO4/c1-2-3-4-11-14-17(22)15-12-9-7-5-6-8-10-13-16-18(23)19(21)20(24)25/h8,10,17-19,22-23H,2-7,9,11-16,21H2,1H3,(H,24,25)/b10-8+