Chem
J-GLOBAL ID:200907062342143470
Nikkaji number:J2.728.473F
3,4-Dihydroxy-5-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]benzoic acid
3,4-ジヒドロキシ-5-[(2E,6E,10E)-3,7,11,15-テトラメチル-2,6,10,14-ヘキサデカテトラエニル]安息香酸
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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:
C27 H38 O4
Molecular formula furigana:
C27-H38-O4
Molecular weight:
426.597
InChI:
InChI=1S/C27H38O4/c1-19(2)9-6-10-20(3)11-7-12-21(4)13-8-14-22(5)15-16-23-17-24(27(30)31)18-25(28)26(23)29/h9,11,13,15,17-18,28-29H,6-8,10,12,14,16H2,1-5H3,(H,30,31)/b20-11+,21-13+,22-15+
InChI key:
BSKXNBAQBKFMLO-FLPKSHQQSA-N
SMILES:
CC(=CCC/C(=C/CC/C(=C/CC/C(=C/Cc1cc(cc(O)c1O)C(=O)O)/C)/C)/C)C
Systematic name (3):
3,4-ジヒドロキシ-5-[(2E,6E,10E)-3,7,11,15-テトラメチル-2,6,10,14-ヘキサデカテトラエニル]安息香酸
3,4-ジヒドロキシ-5-[(2E,6E,10E)-3,7,11,15-テトラメチルヘキサデカ-2,6,10,14-テトラエン-1-イル]安息香酸
3,4-dihydroxy-5-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]benzoic acid
Other name (1):
3,4-Dihydroxy-5-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]benzoic acid
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