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20:3 Cholesteryl ester-[d7]

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Category	Standards
Catalog NO.	BPG-3163
Product Name	20:3 Cholesteryl ester-[d7]
CAS	2342574-76-7
Molecular Formula	C47H71D7O2
Molecular Weight	682.16

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Synonyms	cholesteryl-d7 eicosa-11,14,17-trienoate; 20:3 cholesteryl-d7 ester; CE(20:3)-d7; cholesteryl all-cis-icosa-11,14,17-trienoate-d7; CE(20:3(11Z,14Z,17Z))-d7; cholesteryl (11Z,14Z,17Z)-eicosatrienoate-d7; (3beta)-cholest-5-en-3-yl (11Z,14Z,17Z)-icosa-8,11,14-trienoate-d7; CE 20:3-d7
IUPAC Name	[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (11Z,14Z,17Z)-icosa-11,14,17-trienoate
Canonical SMILES	CCC=CCC=CCC=CCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
InChI	InChI=1S/C47H78O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h8-9,11-12,14-15,28,37-38,40-44H,7,10,13,16-27,29-36H2,1-6H3/b9-8-,12-11-,15-14-/t38-,40+,41+,42-,43+,44+,46+,47-/m1/s1/i2D3,3D3,37D
InChIKey	ARRNWLFGLUXSFU-XLVYXQJTSA-N
Purity	>99%
Solubility	Soluble in DCM, Methanol
Shelf Life	3 Months
Storage	Store at -20°C
Exact Mass	681.64
Hygroscopic	No
Light Sensitive	No
Percent Composition	C 82.75%, H 12.56%, O 4.69%

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