Chem
J-GLOBAL ID：200907081348636049
Nikkaji number：J660.463C
(9Z,9′Z)-5,5′,6,6′-Tetrahydro-β,β-carotene-4,4′-dione
(9Z,9′Z)-5,5′,6,6′-テトラヒドロ-β,β-カロテン-4,4′-ジオン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C40H56O2
Molecular formula furigana： C40-H56-O2
Molecular weight： 568.886
InChI：
InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-35-33(5)37(41)25-27-39(35,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-36-34(6)38(42)26-28-40(36,9)10/h11-24,33-36H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19-,32-20-
InChI key：
PJYHZSCGWKQKPK-QGLVDCRNSA-N
SMILES：
CC1C(/C=C/C(=C\C=C\C(=C\C=C\C=C(/C)\C=C\C=C(\C)/C=C/C2C(C)C(=O)CCC2(C)C)\C)/C)C(C)(C)CCC1=O
Systematic name (3)：
- (9Z,9′Z)-5,5′,6,6′-テトラヒドロ-β,β-カロテン-4,4′-ジオン
- 2,4,4-トリメチル-3-[(1E,3Z,5E,7E,9E,11E,13E,15Z,17E)-3,7,12,16-テトラメチル-18-(2,2,6-トリメチル-5-オキソシクロヘキシル)オクタデカ-1,3,5,7,9,11,13,15,17-ノナエン-1-イル]シクロヘキサン-1-オン
- 2,4,4-trimethyl-3-[(1E,3Z,5E,7E,9E,11E,13E,15Z,17E)-3,7,12,16-tetramethyl-18-(2,2,6-trimethyl-5-oxocyclohexyl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohexan-1-one
- (9Z,9′Z)-5,5′,6,6′-Tetrahydro-β,β-carotene-4,4′-dione
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