2-azanyl-2-(hydroxymethyl)-3,4-bis(oxidanyl)-14-oxidanylidene-icosanoic acid

Systemtic Name: 2-azanyl-2-(hydroxymethyl)-3,4-bis(oxidanyl)-14-oxidanylidene-icosanoic acid Openeye Name: 2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxo-icosanoic acid CAS Name: 2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoeicosanoic acid IUPAC Name: 2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoicosanoic acid Traditional Name: 2-amino-3,4-dihydroxy-14-keto-2-methylol-arachidic acid Formula: C21H41NO6 MolecularWeight: 403.55334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CCCCCCCCCC(C(C(CO)(C(=O)O)N)O)O

Isomeric SMILES

CCCCCCC(=O)CCCCCCCCCC(C(C(CO)(C(=O)O)N)O)O

InChI

InChI=1S/C21H41NO6/c1-2-3-4-10-13-17(24)14-11-8-6-5-7-9-12-15-18(25)19(26)21(22,16-23)20(27)28/h18-19,23,25-26H,2-16,22H2,1H3,(H,27,28)