5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-(15-oxidanylidenepentadecanoyloxy)hexanoic acid

Systemtic Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-(15-oxidanylidenepentadecanoyloxy)hexanoic acid Openeye Name: 5-(tert-butoxycarbonylamino)-6-oxo-6-(15-oxopentadecanoyloxy)hexanoic acid CAS Name: 6-(1,15-dioxopentadecoxy)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-(15-oxopentadecanoyloxy)hexanoic acid Traditional Name: 5-(tert-butoxycarbonylamino)-6-keto-6-(15-ketopentadecanoyloxy)hexanoic acid Formula: C26H45NO8 MolecularWeight: 499.6374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC(=O)O)C(=O)OC(=O)CCCCCCCCCCCCCC=O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC(=O)O)C(=O)OC(=O)CCCCCCCCCCCCCC=O

InChI

InChI=1S/C26H45NO8/c1-26(2,3)35-25(33)27-21(17-16-18-22(29)30)24(32)34-23(31)19-14-12-10-8-6-4-5-7-9-11-13-15-20-28/h20-21H,4-19H2,1-3H3,(H,27,33)(H,29,30)