4-coumaroylshikimate
public_id
FDB030493
IUPAC 名称
3,4-dihydroxy-5-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohex-1-ene-1-carboxylic acid
描述
4-coumaroylshikimate is practically insoluble (in water) and a weakly acidic compound (based on its pKa). 4-coumaroylshikimate can be found in a number of food items such as arctic blackberry, spinach, prickly pear, and java plum, which makes 4-coumaroylshikimate a potential biomarker for the consumption of these food products.
CAS号
异构
OC1C=C(CC(OC(=O)C=CC2=CC=C(O)C=C2)C1O)C(O)=O
InChI标识符
InChI=1S/C16H16O7/c17-11-4-1-9(2-5-11)3-6-14(19)23-13-8-10(16(21)22)7-12(18)15(13)20/h1-7,12-13,15,17-18,20H,8H2,(H,21,22)
GVECSFFLZYNEBO-UHFFFAOYSA-N
平均分子量
320.089602855
id
30656
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