sodium (2S,3S)-3-oxidanyl-2-(undec-10-enoylamino)butanoate

Systemtic Name: sodium (2S,3S)-3-oxidanyl-2-(undec-10-enoylamino)butanoate Openeye Name: sodium (2S,3S)-3-hydroxy-2-(undec-10-enoylamino)butanoate CAS Name: sodium (2S,3S)-3-hydroxy-2-(1-oxoundec-10-enylamino)butanoate IUPAC Name: sodium (2S,3S)-3-hydroxy-2-(undec-10-enoylamino)butanoate Traditional Name: sodium (2S,3S)-3-hydroxy-2-(undec-10-enoylamino)butyrate Formula: C15H26NNaO4 MolecularWeight: 307.36101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)CCCCCCCCC=C)O.[Na+]

Isomeric SMILES

C[C@@H]([C@@H](C(=O)[O-])NC(=O)CCCCCCCCC=C)O.[Na+]

InChI

InChI=1S/C15H27NO4.Na/c1-3-4-5-6-7-8-9-10-11-13(18)16-14(12(2)17)15(19)20;/h3,12,14,17H,1,4-11H2,2H3,(H,16,18)(H,19,20);/q;+1/p-1/t12-,14-;/m0./s1