Chem
J-GLOBAL ID：200907026190277320   Nikkaji number：J384.903A

Carbonic acid [2-[[12-[2-(benzoyloxy)propyl]-3,10-dihydro-4,9-dihydroxy-2,6,7,11-tetramethoxy-3,10-dioxoperylen]-1-yl]-1-methylethyl]4-hydroxyphenyl ester

炭酸[2-[[12-[2-(ベンゾイルオキシ)プロピル]-3,10-ジヒドロ-4,9-ジヒドロキシ-2,6,7,11-テトラメトキシ-3,10-ジオキソペリレン]-1-イル]-1-メチルエチル]4-ヒドロキシフェニル
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： C44H38O14
Molecular formula furigana： C44-H38-O14
Molecular weight： 790.774
InChI： InChI=1S/C44H38O14/c1-20(56-43(50)22-10-8-7-9-11-22)16-25-31-32-26(17-21(2)57-44(51)58-24-14-12-23(45)13-15-24)42(55-6)40(49)34-28(47)19-30(53-4)36(38(32)34)35-29(52-3)18-27(46)33(37(31)35)39(48)41(25)54-5/h7-15,18-21,45-47H,16-17H2,1-6H3
InChI key： SRJYZPCBWDVSGO-UHFFFAOYSA-N
SMILES： COc1cc(O)c2c3c1c1c(OC)cc(O)c4c1c(C(=C(OC)C4=O)CC(C)OC(=O)c1ccccc1)c3C(=C(OC)C2=O)CC(C)OC(=O)Oc1ccc(O)cc1
Systematic name  (3)：
  • 炭酸[2-[[12-[2-(ベンゾイルオキシ)プロピル]-3,10-ジヒドロ-4,9-ジヒドロキシ-2,6,7,11-テトラメトキシ-3,10-ジオキソペリレン]-1-イル]-1-メチルエチル]4-ヒドロキシフェニル
  • 1-[4,9-ジヒドロキシ-12-(2-{[(4-ヒドロキシフェノキシ)カルボニル]オキシ}プロピル)-2,6,7,11-テトラメトキシ-3,10-ジオキソ-3,10-ジヒドロペリレン-1-イル]プロパン-2-イル ベンゾアート
  • 1-[4,9-dihydroxy-12-(2-{[(4-hydroxyphenoxy)carbonyl]oxy}propyl)-2,6,7,11-tetramethoxy-3,10-dioxo-3,10-dihydroperylen-1-yl]propan-2-yl benzoate
Other name (1)：
  • Carbonic acid [2-[[12-[2-(benzoyloxy)propyl]-3,10-dihydro-4,9-dihydroxy-2,6,7,11-tetramethoxy-3,10-dioxoperylen]-1-yl]-1-methylethyl]4-hydroxyphenyl ester
Thsaurus map：
Thesaurus Map

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