public_id

FDB000313

IUPAC 名称

(2S,5S,7S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methyl-5-methylideneheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-5-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

描述

24-methylenecholestanol ferulate is a member of the class of compounds known as steroid esters. Steroid esters are compounds containing a steroid moiety which bears a carboxylic acid ester group. 24-methylenecholestanol ferulate is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 24-methylenecholestanol ferulate can be found in corn, which makes 24-methylenecholestanol ferulate a potential biomarker for the consumption of this food product.

CAS号

异构

COC1=C(O)C=CC(\C=C\C(=O)O[C@H]2CC[C@]3(C)C4CC[C@]5(C)[C@H](CCC5C4CC[C@@]3([H])C2)[C@H](C)CCC(=C)C(C)C)=C1

InChI标识符

InChI=1S/C38H56O4/c1-24(2)25(3)8-9-26(4)31-14-15-32-30-13-12-28-23-29(18-20-37(28,5)33(30)19-21-38(31,32)6)42-36(40)17-11-27-10-16-34(39)35(22-27)41-7/h10-11,16-17,22,24,26,28-33,39H,3,8-9,12-15,18-21,23H2,1-2,4-7H3/b17-11+/t26-,28+,29+,30?,31-,32?,33?,37+,38-/m1/s1

键

DOIYKIUFHRPGDF-IGQWCCQJSA-N

平均分子量

576.41786028

id

313

含有化合物的食物

食物id	食物名称
85	Soy bean
177	Sorghum
169	Rye
125	Rice
235	Red rice
450	Quinoa
552	Oriental wheat
22	Oat
126	Millet
242	Hard wheat
825	Flour
205	Corn
187	Common wheat
79	Common buckwheat
888	Cereals and cereal products
766	Bulgur
270	Breakfast cereal
88	Barley
236	Annual wild rice
289	Amaranth