Chem
J-GLOBAL ID:200907040707798582
Nikkaji number:J508.609D
Diacetic acid (3S,5S)-1-(4-acetoxy-3,5-dimethoxyphenyl)-7-(4-acetoxy-3-methoxyphenyl)heptane-3,5-diyl ester
二酢酸(3S,5S)-1-(4-アセトキシ-3,5-ジメトキシフェニル)-7-(4-アセトキシ-3-メトキシフェニル)ヘプタン-3,5-ジイル
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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 H38 O11
Molecular formula furigana:
C30-H38-O11
Molecular weight:
574.623
InChI:
InChI=1S/C30H38O11/c1-18(31)38-24(11-8-22-10-13-26(40-20(3)33)27(14-22)35-5)17-25(39-19(2)32)12-9-23-15-28(36-6)30(41-21(4)34)29(16-23)37-7/h10,13-16,24-25H,8-9,11-12,17H2,1-7H3/t24-,25-/m0/s1
InChI key:
XWAZRIWSJSLBBD-DQEYMECFSA-N
SMILES:
COc1cc(CC[C@@H](C[C@H](CCc2cc(OC)c(OC(=O)C)c(OC)c2)OC(=O)C)OC(=O)C)ccc1OC(=O)C
Systematic name (3):
二酢酸(3S,5S)-1-(4-アセトキシ-3,5-ジメトキシフェニル)-7-(4-アセトキシ-3-メトキシフェニル)ヘプタン-3,5-ジイル
(3S,5S)-5-(アセチルオキシ)-7-[4-(アセチルオキシ)-3,5-ジメトキシフェニル]-1-[4-(アセチルオキシ)-3-メトキシフェニル]ヘプタン-3-イル アセタート
(3S,5S)-5-(acetyloxy)-7-[4-(acetyloxy)-3,5-dimethoxyphenyl]-1-[4-(acetyloxy)-3-methoxyphenyl]heptan-3-yl acetate
Other name (1):
Diacetic acid (3S,5S)-1-(4-acetoxy-3,5-dimethoxyphenyl)-7-(4-acetoxy-3-methoxyphenyl)heptane-3,5-diyl ester
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