2-[[(3R)-15-methyl-3-[(Z)-13-methyltetradec-4-enoyl]oxy-hexadecanoyl]amino]ethanoic acid

Systemtic Name: 2-[[(3R)-15-methyl-3-[(Z)-13-methyltetradec-4-enoyl]oxy-hexadecanoyl]amino]ethanoic acid Openeye Name: 2-[[(3R)-15-methyl-3-[(Z)-13-methyltetradec-4-enoyl]oxy-hexadecanoyl]amino]acetic acid CAS Name: 2-[[(3R)-15-methyl-3-[(Z)-13-methyl-1-oxotetradec-4-enoxy]-1-oxohexadecyl]amino]acetic acid IUPAC Name: 2-[[(3R)-15-methyl-3-[(Z)-13-methyltetradec-4-enoyl]oxyhexadecanoyl]amino]acetic acid Traditional Name: 2-[[(3R)-15-methyl-3-[(Z)-13-methyltetradec-4-enoyl]oxy-hexadecanoyl]amino]acetic acid Formula: C34H63NO5 MolecularWeight: 565.86772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(CC(=O)NCC(=O)O)OC(=O)CCC=CCCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCCCCC[C@H](CC(=O)NCC(=O)O)OC(=O)CC/C=C\CCCCCCCC(C)C

InChI

InChI=1S/C34H63NO5/c1-29(2)23-19-15-11-7-5-9-13-17-21-25-31(27-32(36)35-28-33(37)38)40-34(39)26-22-18-14-10-6-8-12-16-20-24-30(3)4/h14,18,29-31H,5-13,15-17,19-28H2,1-4H3,(H,35,36)(H,37,38)/b18-14-/t31-/m1/s1