dihydroxyferuloyl-sinapoyl spermidine
IUPAC 名称
N-{3-[3-(3,4-dihydroxy-5-methoxyphenyl)-N-{4-[3-(3,4-dihydroxy-5-methoxyphenyl)prop-2-enamido]butyl}prop-2-enamido]propyl}-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enamide
描述
Dihydroxyferuloyl-sinapoyl spermidine belongs to hydroxycinnamic acids and derivatives class of compounds. Those are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated. Dihydroxyferuloyl-sinapoyl spermidine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Dihydroxyferuloyl-sinapoyl spermidine can be found in a number of food items such as ginseng, dock, oriental wheat, and mexican oregano, which makes dihydroxyferuloyl-sinapoyl spermidine a potential biomarker for the consumption of these food products.
异构
COC1=CC(C=CC(=O)NCCCCN(CCCNC(=O)C=CC2=CC(OC)=C(O)C(OC)=C2)C(=O)C=CC2=CC(OC)=C(O)C(O)=C2)=CC(O)=C1O
InChI标识符
InChI=1S/C38H45N3O12/c1-50-29-20-24(18-27(42)36(29)47)8-11-33(44)39-14-5-6-16-41(35(46)13-10-25-19-28(43)37(48)30(21-25)51-2)17-7-15-40-34(45)12-9-26-22-31(52-3)38(49)32(23-26)53-4/h8-13,18-23,42-43,47-49H,5-7,14-17H2,1-4H3,(H,39,44)(H,40,45)
键
FDECXSCMWXHRNU-UHFFFAOYSA-N