Chem
J-GLOBAL ID:200907035916182072
Nikkaji number:J819.774A
β-Cryptoxanthin acetate
β-クリプトキサンチンアセタート
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Substance type:
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
Molecular formula:
C42 H58 O2
Molecular formula furigana:
C42-H58-O2
Molecular weight:
594.924
InChI:
InChI=1S/C42H58O2/c1-31(19-14-21-33(3)24-26-39-35(5)23-16-28-41(39,8)9)17-12-13-18-32(2)20-15-22-34(4)25-27-40-36(6)29-38(44-37(7)43)30-42(40,10)11/h12-15,17-22,24-27,38H,16,23,28-30H2,1-11H3/b13-12+,19-14+,20-15+,26-24+,27-25+,31-17+,32-18+,33-21+,34-22+/t38-/m1/s1
InChI key:
FMPGIACYOGJFQX-CPQPWORTSA-N
SMILES:
CC(=O)O[C@@H]1CC(=C(/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C)CCCC2(C)C)/C)/C)C(C)(C)C1)C
Systematic name (3):
(3R)-β,β-カロテン-3-オールアセタート
(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-(2,6,6-トリメチルシクロヘキサ-1-エン-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-イル アセタート
(1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-1-en-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohex-3-en-1-yl acetate
Other name (3):
β-クリプトキサンチンアセタート
β-Cryptoxanthin acetate
(3R)-β,β-Caroten-3-ol acetate
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