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Cholesteryl oleate-[13C7,d6]

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General Information
Catalog: BLP-000146
Molecular Formula: C38[13C]7H72D6O2
Molecular Weight: 664.09

Chemical Structure

Description	Cholesteryl oleate-[13C7,d6], is the labelled analogue of Cholic acid, Cholic acid could inhibit the activity of cardiac myocytes by causing calcium overload, thereby leading to the sudden fetal death in ICP.
Synonyms	Cholesteryl-26,26,26,27,27,27-d6 oleate-1,2,3,7,8,9,10-13C7
IUPAC Name	[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-7,7,7-trideuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-(1,2,3,7,8,9,10-13C7)octadec-9-enoate
Related CAS	303-43-5 (unlabelled)
Canonical SMILES	CCCCCCCCC=CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
InChI	1S/C45H78O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h14-15,26,35-36,38-42H,7-13,16-25,27-34H2,1-6H3/b15-14-/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1/i2D3,3D3,14+1,15+1,16+1,17+1,21+1,25+1,43+1
InChI Key	RJECHNNFRHZQKU-ZCOCGJGQSA-N
Melting Point	44-47 °C
Purity	97% (CP); 99% atom 13C; 98% atom D
Appearance	Solid
Storage	Store at -20°C