Chem
J-GLOBAL ID:200907001307278495
Nikkaji number:J1.666.009D
2-(3,4-Dihydroxyphenyl)-3,8-dihydroxy-5-methyl-1-oxonia-6-oxa-6H-phenalene
2-(3,4-ジヒドロキシフェニル)-3,8-ジヒドロキシ-5-メチル-1-オキソニア-6-オキサ-6H-フェナレン
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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 H13 O5 [O+]
Molecular formula furigana:
C18-H13-O6
Molecular weight:
325.295
InChI:
InChI=1S/C18H12O6/c1-8-4-11-16-14(23-8)6-10(19)7-15(16)24-18(17(11)22)9-2-3-12(20)13(21)5-9/h2-7H,1H3,(H3-,19,20,21,22)/p+1
InChI key:
QLAAIXZMYKXXMX-UHFFFAOYSA-O
SMILES:
CC1=Cc2c(O)c([o+]c3cc(O)cc(O1)c23)c1ccc(O)c(O)c1
Systematic name (3):
2-(3,4-ジヒドロキシフェニル)-3,8-ジヒドロキシ-5-メチル-1-オキソニア-6-オキサ-6H-フェナレン
3-(3,4-ジヒドロキシフェニル)-4,11-ジヒドロキシ-7-メチル-2λ4, 8-ジオキサトリシクロ[7.3.1.05,13 ]トリデカ-1(12),2,4,6,9(13),10-ヘキサエン-2-イリウム
3-(3,4-dihydroxyphenyl)-4,11-dihydroxy-7-methyl-2λ4, 8-dioxatricyclo[7.3.1.05,13 ]trideca-1(12),2,4,6,9(13),10-hexaen-2-ylium
Other name (1):
2-(3,4-Dihydroxyphenyl)-3,8-dihydroxy-5-methyl-1-oxonia-6-oxa-6H-phenalene
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