isoleucine betaine,化合物成分

isoleucine betaine

public_id

FDB093489

IUPAC 名称

3-methyl-2-(trimethylazaniumyl)pentanoate

描述

CAS号

异构

C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2C2=C(O)C3=C(OC(=CC3=O)C3=CC=C(O)C=C3)C=C2O)[C@H](O)[C@H](O)[C@H]1O

InChI标识符

InChI=1S/C27H30O14/c1-9-19(32)22(35)24(37)27(38-9)41-26-23(36)20(33)16(8-28)40-25(26)18-13(31)7-15-17(21(18)34)12(30)6-14(39-15)10-2-4-11(29)5-3-10/h2-7,9,16,19-20,22-29,31-37H,8H2,1H3/t9-,16+,19-,20+,22+,23-,24+,25-,26+,27-/m0/s1

键

BGPMMCPSTAYIEL-UTKQBPCESA-N

平均分子量

578.163555646

id

121104

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