Chem
J-GLOBAL ID：200907035157874410
Nikkaji number：J1.680.397I
4-Hydroxy-trans-cinnamic acid 4-[1-(α,4-dihydroxy-3-methoxybenzyl)-2-(4-hydroxy-trans-cinnamoyloxy)ethoxy]-3-methoxy-trans-cinnamyl ester
4-ヒドロキシ-trans-けい皮酸4-[1-(α,4-ジヒドロキシ-3-メトキシベンジル)-2-(4-ヒドロキシ-trans-シンナモイルオキシ)エトキシ]-3-メトキシ-trans-シンナミル
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
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
Molecular formula： C38H36O11
Molecular formula furigana： C38-H36-O11
Molecular weight： 668.695
InChI：
InChI=1S/C38H36O11/c1-45-33-23-28(12-17-31(33)41)38(44)35(24-48-37(43)20-11-26-7-15-30(40)16-8-26)49-32-18-9-27(22-34(32)46-2)4-3-21-47-36(42)19-10-25-5-13-29(39)14-6-25/h3-20,22-23,35,38-41,44H,21,24H2,1-2H3/b4-3+,19-10+,20-11+
InChI key：
QXHQDOXKUWAPCH-NEGJHZKESA-N
SMILES：
COc1cc(ccc1O)C(O)C(COC(=O)/C=C/c1ccc(O)cc1)Oc1ccc(/C=C/COC(=O)/C=C/c2ccc(O)cc2)cc1OC
Systematic name (3)：
- 4-ヒドロキシ-trans-けい皮酸4-[1-(α,4-ジヒドロキシ-3-メトキシベンジル)-2-(4-ヒドロキシ-trans-シンナモイルオキシ)エトキシ]-3-メトキシ-trans-シンナミル
- (2E)-3-(4-{[1-ヒドロキシ-1-(4-ヒドロキシ-3-メトキシフェニル)-3-{[(2E)-3-(4-ヒドロキシフェニル)プロパ-2-エノイル]オキシ}プロパン-2-イル]オキシ}-3-メトキシフェニル)プロパ-2-エン-1-イル (2E)-3-(4-ヒドロキシフェニル)プロパ-2-エノアート
- (2E)-3-(4-{[1-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-{[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}propan-2-yl]oxy}-3-methoxyphenyl)prop-2-en-1-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate
- 4-Hydroxy-trans-cinnamic acid 4-[1-(α,4-dihydroxy-3-methoxybenzyl)-2-(4-hydroxy-trans-cinnamoyloxy)ethoxy]-3-methoxy-trans-cinnamyl ester
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