(3S,3'S,5R,5'R)-3,3'-Dihydroxy-kappa,kappa-Carotene-6,6'-Dione
[CAS# 470-38-2]

Identification

• Name: (3S,3'S,5R,5'R)-3,3'-Dihydroxy-kappa,kappa-Carotene-6,6'-Dione
• Synonyms: (2E,4E,6E,8E,10E,12E,14E,16E,18E)-1,20-Bis[(1R,4S)-4-Hydroxy-1,2,2-Trimethyl-Cyclopentyl]-4,8,13,17-Tetramethyl-Icosa-2,4,6,8,10,12,14,16,18-Nonaene-1,20-Dione; (3S,3'S,5R,5'R)-3,3'-Dihydroxy-Kappa,Kappa-Carotene-6,6'-Dione
• Molecular Formula: C₄₀H₅₆O₄
• Molecular Weight: 600.88
• CAS Registry Number: 470-38-2
• EINECS: 207-425-2
• SMILES: [C@]1(C(C[C@@H](C1)O)(C)C)(C(/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C([C@]2(C(C[C@@H](C2)O)(C)C)C)=O)C)C)C)C)=O)C
• InChI: 1S/C40H56O4/c1-29(17-13-19-31(3)21-23-35(43)39(9)27-33(41)25-37(39,5)6)15-11-12-16-30(2)18-14-20-32(4)22-24-36(44)40(10)28-34(42)26-38(40,7)8/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t33-,34-,39-,40-/m0/s1
• InChIKey: GVOIABOMXKDDGU-YUURSNASSA-N

Properties

• Density: 1.017g/cm³ (Cal.)
• Boiling point: 741.811°C at 760 mmHg (Cal.)
• Flash point: 416.366°C (Cal.)