(3S,3'S)-4',5'-Didehydro-4,5'-retro-beta,beta-carotene-3,3'-diol

(1S,4E)-4-[(2E,4E,6E,8E,10E,12E,14E,16E,18E)-18-[(4S)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-ylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene]-3,5,5-trimethylcyclohex-2-en-1-ol

Also Known As: Eschscholtzxanthin|(1S,4E)-4-[(2E,4E,6E,8E,10E,12E,14E,16E,18E)-18-[(4S)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-ylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene]-3,5,5-trimethylcyclohex-2-en-1-ol|(3S,3'S)-4',5'-Didehydro-4,5'-retro-beta,beta-carotene-3,3'-diol|(3S,3 S)-4 ,5 -Didehydro-4,5 -retro-beta,beta-carotene-3,3 -diol|(1S)-4-[(2E,4E,6E,8E,10E,12E,14E,16E)-18-[(4S)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-ylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaen-1-ylidene]-3,5,5-trimethylcyclohex-2-en-1-ol|(1S,4E)-4-((2E,4E,6E,8E,10E,12E,14E,16E,18E)-18-((4S)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-ylidene)-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene)-3,5,5-trimethylcyclohex-2-en-1-ol|(3S,3'S,6E,6'E,8E,8'E,10E,10'E,12E,12'E,14E,14'E)-4,4'-Didehydro-beta,beta-carotene-3,3'-diol

Molecular Formula	C40H54O2
Molecular Weight	566.41235 g/mol
LogP	10.3234
Topological Polar Surface Area	40.46 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	9
Exact Mass	566.41235
Monoisotopic Mass	566.41235
Heavy Atoms	42
Complexity	1229.2916

Chemical Identifiers

CAS Number	472-75-3
SMILES	CC\1=C[C@H](CC(/C1=C\C=C(\C=C\C=C(\C=C\C=C\C(=C\C=C\C(=C\C=C\2/C(C[C@@H](C=C2C)O)(C)C)\C)\C)/C)/C)(C)C)O