Halocynthiaxanthin
[CAS# 81306-52-7]

Identification

• Name: Halocynthiaxanthin
• Synonyms: (3E,5E,7E,9E,11E,13E,15E)-18-(4-Hydroxy-2,6,6-Trimethyl-1-Cyclohexenyl)-1-(4-Hydroxy-2,2,6-Trimethyl-7-Oxabicyclo[4.1.0]Heptan-1-Yl)-3,7,12,16-Tetramethyl-Octadeca-3,5,7,9,11,13,15-Heptaen-17-Yn-2-One; Beta,Beta-Carotene-3,3'-Diol, 7,8-Didehydro-5',6'-Epoxy-5',6',7',8'-Tetrahydro-8'-Oxo-, (3R,3'S,5'R,6'S)-
• Molecular Formula: C₄₀H₅₄O₄
• Molecular Weight: 598.86
• CAS Registry Number: 81306-52-7
• SMILES: C(C12OC1(CC(O)CC2(C)C)C)C(=O)C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(C#CC3=C(CC(O)CC3(C)C)C)\C)C)C)/C
• InChI: 1S/C40H54O4/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)24-37(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36(43)27-40-38(8,9)25-34(42)26-39(40,10)44-40/h11-20,33-34,41-42H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+
• InChIKey: CNOIXMULOQWVGR-XFULSKPLSA-N