Chem
J-GLOBAL ID:200907079060716361
Nikkaji number:J924.700I
1-(4-Hydroxy-3-methoxyphenyl)-2-[4-[[2,3-dihydro-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran]-2-yl]-2-methoxyphenyl]-1,3-propanediol
1-(4-ヒドロキシ-3-メトキシフェニル)-2-[4-[[2,3-ジヒドロ-3-(ヒドロキシメチル)-5-(3-ヒドロキシプロピル)-7-メトキシベンゾフラン]-2-イル]-2-メトキシフェニル]-1,3-プロパンジオール
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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:
C30 H36 O9
Molecular formula furigana:
C30-H36-O9
Molecular weight:
540.609
InChI:
InChI=1S/C30H36O9/c1-36-25-14-19(6-8-20(25)22(15-32)28(35)18-7-9-24(34)26(13-18)37-2)29-23(16-33)21-11-17(5-4-10-31)12-27(38-3)30(21)39-29/h6-9,11-14,22-23,28-29,31-35H,4-5,10,15-16H2,1-3H3
InChI key:
RMCBYFMRJQTZLZ-UHFFFAOYSA-N
SMILES:
COc1cc(CCCO)cc2C(CO)C(Oc12)c1ccc(C(CO)C(O)c2ccc(O)c(OC)c2)c(OC)c1
Systematic name (3):
1-(4-ヒドロキシ-3-メトキシフェニル)-2-[4-[[2,3-ジヒドロ-3-(ヒドロキシメチル)-5-(3-ヒドロキシプロピル)-7-メトキシベンゾフラン]-2-イル]-2-メトキシフェニル]-1,3-プロパンジオール
1-(4-ヒドロキシ-3-メトキシフェニル)-2-{4-[3-(ヒドロキシメチル)-5-(3-ヒドロキシプロピル)-7-メトキシ-2,3-ジヒドロ-1-ベンゾフラン-2-イル]-2-メトキシフェニル}プロパン-1,3-ジオール
1-(4-hydroxy-3-methoxyphenyl)-2-{4-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenyl}propane-1,3-diol
Other name (1):
1-(4-Hydroxy-3-methoxyphenyl)-2-[4-[[2,3-dihydro-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran]-2-yl]-2-methoxyphenyl]-1,3-propanediol
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