Name: (2S,3S,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic Acid-[d3] (Mixture of Diastereomers)
Brand: BOC Sciences
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General Information

Catalog: BLP-006342

CAS: 1356932-14-3

Molecular Formula: C29H52D3NO6

Molecular Weight: 516.77

Chemical Structure

(2S,3S,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic Acid-[d3] (Mixture of Diastereomers)

Description	(2S,3S,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic Acid-[d3] (Mixture of Diastereomers) is the labelled analogue of (2S,3S,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic Acid (Mixture of Diastereomers), which is an impurity of Orlistat.
Synonyms	(2S,3S,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic Acid-d3 (Mixture of Diastereomers); N-Formyl-L-leucine (1S)-1-[(2S,3S)-3-carboxy-2-hydroxynonyl]dodecyl Ester-d3; 5-(Formamido-4-methylpentanoyloxy)-2-hexyl-3-hydroxyhexadecanoic Acid-d3; Orlistat Impurity M1-d3
IUPAC Name	(2S,3S,5S)-2-hexyl-3-hydroxy-5-[(2S)-5,5,5-trideuterio-2-formamido-4-methylpentanoyl]oxyhexadecanoic acid
Related CAS	130676-66-3 (unlabelled)
Canonical SMILES	CCCCCCCCCCCC(CC(C(CCCCCC)C(=O)O)O)OC(=O)C(CC(C)C)NC=O
InChI	InChI=1S/C29H55NO6/c1-5-7-9-11-12-13-14-15-16-18-24(36-29(35)26(30-22-31)20-23(3)4)21-27(32)25(28(33)34)19-17-10-8-6-2/h22-27,32H,5-21H2,1-4H3,(H,30,31)(H,33,34)/t24-,25-,26-,27-/m0/s1/i3D3/t23?,24-,25-,26-,27-
InChI Key	FKUNIADJSAJLGB-HDVRVJOHSA-N
Purity	>95%
Solubility	Soluble in Chloroform
Appearance	Colorless Thick Oily Matter
Storage	Store at -86°C under inert atmosphere