Chem
J-GLOBAL ID:200907009806206820
Nikkaji number:J1.404.467A
1,8-[Oxybis[4-hydroxy-5-(hydroxymethyl)-3,1-phenylene]bisethynylene]anthracene
1,8-[オキシビス[4-ヒドロキシ-5-(ヒドロキシメチル)-3,1-フェニレン]ビスエチニレン]アントラセン
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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:
C32 H20 O5
Molecular formula furigana:
C32-H20-O5
Molecular weight:
484.507
InChI:
InChI=1S/C32H20O5/c33-17-25-11-19-7-9-21-3-1-5-23-15-24-6-2-4-22(28(24)16-27(21)23)10-8-20-12-26(18-34)32(36)30(14-20)37-29(13-19)31(25)35/h1-6,11-16,33-36H,17-18H2
InChI key:
FOCWPVHURVTDPM-UHFFFAOYSA-N
SMILES:
OCc1cc2cc(Oc3cc(cc(CO)c3O)C#Cc3cccc4cc5cccc(C#C2)c5cc34)c1O
Systematic name (3):
1,8-[オキシビス[4-ヒドロキシ-5-(ヒドロキシメチル)-3,1-フェニレン]ビスエチニレン]アントラセン
5,27-ビス(ヒドロキシメチル)-2-オキサヘキサシクロ[23.3.1.13,7 .114,18 .010,15 .017,22 ]ヘントリアコンタ-1(29),3,5,7(31),10,12,14(30),15,17(22),18,20,25,27-トリデカエン-8,23-ジイン-4,28-ジオール
5,27-bis(hydroxymethyl)-2-oxahexacyclo[23.3.1.13,7 .114,18 .010,15 .017,22 ]hentriaconta-1(29),3,5,7(31),10,12,14(30),15,17(22),18,20,25,27-tridecaen-8,23-diyne-4,28-diol
Other name (1):
1,8-[Oxybis[4-hydroxy-5-(hydroxymethyl)-3,1-phenylene]bisethynylene]anthracene
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