12-oxidanylidene-12-[[(2S,3R,4R)-2,3,4,5,6-pentakis(oxidanyl)hexyl]amino]dodecanoic acid

Systemtic Name: 12-oxidanylidene-12-[[(2S,3R,4R)-2,3,4,5,6-pentakis(oxidanyl)hexyl]amino]dodecanoic acid Openeye Name: 12-oxo-12-[[(2S,3R,4R)-2,3,4,5,6-pentahydroxyhexyl]amino]dodecanoic acid CAS Name: 12-oxo-12-[[(2S,3R,4R)-2,3,4,5,6-pentahydroxyhexyl]amino]dodecanoic acid IUPAC Name: 12-oxo-12-[[(2S,3R,4R)-2,3,4,5,6-pentahydroxyhexyl]amino]dodecanoic acid Traditional Name: 12-keto-12-[[(2S,3R,4R)-2,3,4,5,6-pentahydroxyhexyl]amino]lauric acid Formula: C18H35NO8 MolecularWeight: 393.4724

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCC(=O)O)CCCCC(=O)NCC(C(C(C(CO)O)O)O)O

Isomeric SMILES

C(CCCCCC(=O)O)CCCCC(=O)NC[C@@H]([C@H]([C@@H](C(CO)O)O)O)O

InChI

InChI=1S/C18H35NO8/c20-12-14(22)18(27)17(26)13(21)11-19-15(23)9-7-5-3-1-2-4-6-8-10-16(24)25/h13-14,17-18,20-22,26-27H,1-12H2,(H,19,23)(H,24,25)/t13-,14?,17+,18+/m0/s1