Mrv1652309121709242D 9 8 0 0 0 0 999 V2000型-0.1914 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 1.9520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2375 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 1.9520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3809 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 -0.1105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 5 7 1 0 0 0 0 7 8 0 0 0 0 7 9 1 0 0 0 0 M >结束
DB03229 >
drugbank >
CC (C) CC (= O) C (O) = O >
InChI = 1 s / C6H10O3 c1-4 (2) 3 - 5 (7) 6 (8) 9 / h4H 3 h2, 1-2H3 (H, 8, 9) >
BKAJNAXTPSGJCU-UHFFFAOYSA-N >
C6H10O3 >
130.1418 >
130.062994186 >
3 >
19日>
12.995994785498697 >
1 >
1 >
0 >
0 >
4-methyl-2-oxopentanoic酸>
0.82 >
1.4979975616666668 >
-1.28 >
0 >
0 >
1 >
3.528051095084082 >
-9.662090237480372 >
54.37 >
31.7662 >
3 >
1 >
6.76 e + 00 g / l >
ketoisocaproate >
0 >
DB03229 >
EXPT00985 >
实验>
alpha-Ketoisocaproic酸>
2-oxo-4-methylpentanoic酸;2-Oxoisocaproate;2-oxoleucine;4-Methyl-2-oxopentanoate;4-methyl-2-oxopentanoic酸;4-methyl-2-oxovaleric酸;alpha-Ketoisocaproate;Ketoleucine;α-ketoisocaproic酸>
钙4-methyl-2-oxovalerate $ $ $ $