(3S,3'S,5R,5'R,9cis, 9'cis)-5,5',8,8'-Tetrahydro-5,8:5',8'-Diepoxy-beta,beta-Carotene-3,3'-Diol
[CAS# 27785-15-5]

Identification

• Name: (3S,3'S,5R,5'R,9cis, 9'cis)-5,5',8,8'-Tetrahydro-5,8:5',8'-Diepoxy-beta,beta-Carotene-3,3'-Diol
• Synonyms: Auroxanthin
• Molecular Formula: C₄₀H₅₆O₄
• Molecular Weight: 600.87
• CAS Registry Number: 27785-15-5
• SMILES: C/C(=C\C=C\C=C(\C=C\C=C(\C1O[C@]2(C(=C1)C(C[C@@H](C2)O)(C)C)C)/C)/C)/C=C/C=C(/C3O[C@]4(C(=C3)C(C[C@@H](C4)O)(C)C)C)\C
• InChI: 1S/C40H56O4/c1-27(17-13-19-29(3)33-21-35-37(5,6)23-31(41)25-39(35,9)43-33)15-11-12-16-28(2)18-14-20-30(4)34-22-36-38(7,8)24-32(42)26-40(36,10)44-34/h11-22,31-34,41-42H,23-26H2,1-10H3/b12-11+,17-13+,18-14+,27-15+,28-16+,29-19+,30-20+/t31-,32-,33?,34?,39+,40+/m0/s1
• InChIKey: YLUSVJDFTAATNS-RFIAJWJGSA-N

Properties

• Density: 1.084g/cm³ (Cal.)
• Boiling point: 720.759°C at 760 mmHg (Cal.)
• Flash point: 389.701°C (Cal.)
• Refractive index: 1.576 (Cal.)