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13(S)-HODE-[d4]

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General Information
Catalog: BLP-010216
CAS: 139408-39-2
Molecular Formula: C18H28D4O3
Molecular Weight: 300.50

Chemical Structure

Synonyms	13S-hydroxy-9Z,11E-octadecadienoic acid-d4
IUPAC Name	(9Z,11E,13S)-9,10,12,13-tetradeuterio-13-hydroxyoctadeca-9,11-dienoic acid
Related CAS	29623-28-7 (unlabelled)
Canonical SMILES	CCCCCC(C=CC=CCCCCCCCC(=O)O)O
InChI	InChI=1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+/t17-/m0/s1/i7D,9D,15D,17D
InChI Key	HNICUWMFWZBIFP-QEYKCUBVSA-N
Boiling Point	422.7±20.0°C at 760 mmHg
Density	1.0±0.1 g/cm3
Storage	Store at -20°C