Chem
J-GLOBAL ID:200907005134546940
Nikkaji number:J2.643.972H
13-Apoastaxanthinone
13-アポアスタキサンチノン
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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:
C18 H24 O3
Molecular formula furigana:
C18-H24-O3
Molecular weight:
288.387
InChI:
InChI=1S/C18H24O3/c1-12(7-6-8-13(2)19)9-10-15-14(3)17(21)16(20)11-18(15,4)5/h6-10,16,20H,11H2,1-5H3/b8-6+,10-9+,12-7+/t16-/m0/s1
InChI key:
XCKNHAHISXKJLT-JTEDGRHNSA-N
SMILES:
CC(=O)/C=C/C=C(\C)/C=C/C1=C(C)C(=O)[C@@H](O)CC1(C)C
Systematic name (3):
(S)-6-ヒドロキシ-2,4,4-トリメチル-3-[(1E,3E,5E)-3-メチル-7-オキソオクタ-1,3,5-トリエニル]-2-シクロヘキセン-1-オン
(6S)-6-ヒドロキシ-2,4,4-トリメチル-3-[(1E,3E,5E)-3-メチル-7-オキソオクタ-1,3,5-トリエン-1-イル]シクロヘキサ-2-エン-1-オン
(6S)-6-hydroxy-2,4,4-trimethyl-3-[(1E,3E,5E)-3-methyl-7-oxoocta-1,3,5-trien-1-yl]cyclohex-2-en-1-one
Other name (3):
(S)-6-Hydroxy-2,4,4-trimethyl-3-[(1E,3E,5E)-3-methyl-7-oxoocta-1,3,5-trienyl]-2-cyclohexene-1-one
13-アポアスタキサンチノン
13-Apoastaxanthinone
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