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Beta-carotene-[10,10',19,19,19,19',19',19'-d8]

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General Information
Catalog: BLP-005886
CAS: 53163-44-3
Molecular Formula: C40H48D8
Molecular Weight: 544.92

Chemical Structure

Description	Beta-carotene-[10,10',19,19,19,19',19',19'-d8] is an isotope labelled compound of β-Carotin. β-Carotene has been used as a standard to measure β-carotene levels in plasma samples via HPLC (high performance liquid chromatography).
Synonyms	Beta-carotene (10,10',19,19,19,19',19',19'-D8); β-Carotin-d8; beta-carotene D8
IUPAC Name	2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-4,15-dideuterio-7,12-dimethyl-3,16-bis(trideuteriomethyl)-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-1,3,3-trimethylcyclohexene
Related CAS	7235-40-7 (unlabelled)
Canonical SMILES	CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C
InChI	InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+/i3D3,4D3,21D,22D
InChI Key	OENHQHLEOONYIE-QVOKSWBTSA-N
Purity	98% by CP; 97% atom D