Chem
J-GLOBAL ID：200907081919061995
Nikkaji number：J819.777F
(3R,5′R,6′S)-5′,6′-Epoxy-β-cryptoxanthin
(3R,5′R,6′S)-5′,6′-エポキシ-β-クリプトキサンチン
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/c1-30(18-13-20-32(3)22-23-36-34(5)28-35(41)29-37(36,6)7)16-11-12-17-31(2)19-14-21-33(4)24-27-40-38(8,9)25-15-26-39(40,10)42-40/h11-14,16-24,27,35,41H,15,25-26,28-29H2,1-10H3/b12-11+,18-13+,19-14+,23-22+,27-24+,30-16+,31-17+,32-20+,33-21+/t35-,39-,40+/m1/s1
InChI key：
LLQCIZOXARRMDO-HGTNRAFMSA-N
SMILES：
C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\[C@@]12O[C@]1(C)CCCC2(C)C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C
Systematic name (4)：
- (3R,5′R,6′S)-5′,6′-エポキシ-β,β-カロテン-3-オール
- (3R)-5′α,6′α-エポキシ-5′,6′-ジヒドロ-β,β-カロテン-3-オール
- (1R)-3,5,5-トリメチル-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-テトラメチル-18-[(1S,6R)-2,2,6-トリメチル-7-オキサビシクロ[4.1.0]ヘプタン-1-イル]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-3-エン-1-オール
- (1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-[(1S,6R)-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohex-3-en-1-ol
- (3R,5′R,6′S)-5′,6′-エポキシ-β-クリプトキサンチン
- (3R,5′R,6′S)-5′,6′-Epoxy-β-cryptoxanthin
- (3R,5′R,6′S)-5′,6′-Epoxy-β,β-caroten-3-ol
- (3R)-5′α,6′α-Epoxy-5′,6′-dihydro-β,β-carotene-3-ol
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