246 Mrv1909 02042017092 d 15 16 0 0 0 0 999 V2000型5.8073 3.0921 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.0379 2.2671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7314 2.9310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8073 0.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8073 1.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5218 1.8546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9507 1.8546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2362 1.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9507 2.6796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5218 2.6796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7314 1.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2362 3.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2128 2.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0928 0.2044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5217 0.2044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 2 13 2 0 0 0 0 3 1 9 0 0 0 0 3 13 1 0 0 0 0 5 6 6 8 1 1 0 0 0 0 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 12 2 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 4 1 5 0 0 0 0 4 14 2 0 0 0 0 4 15 1 0 0 0 0 M >结束
DBMET02986 >
drugbank >
OC (= O) CC1 = C (Cl) C = C2NC (= O) CC2 C1 = >
InChI = 1 s / C10H8ClNO3 / c11-7-4-8-6(2 - 9(13)负)1 - 5 (7)3 - 10 (14)15 / h1, 4 H, 2-3H2, (H、12、13) (H, 14、15) >
GXUUMUNKZDELCQ-UHFFFAOYSA-N >
C10H8ClNO3 >
225.63 >
225.0192708 >
3 >
23日>
-0.00026698304011691683 >
20.972238268153514 >
1 >
2 >
0 >
1 >
2 - (6-chloro-2-oxo-2 3-dihydro-1H-indol-5-yl)乙酸>
1.09 >
1.3138431526666667 >
-2.54 >
0 >
1 >
2 >
1 >
12.105059206070655 >
3.573400361694849 >
-5.503306816180055 >
66.4 >
55.69730000000001 >
2 >
1 >
6.46 e-01 g / l >
(6-chloro-2-oxo-1 3-dihydroindol-5-yl)乙酸>
0 >
DBMET02986 >
(6-chloro-2-oxo-2 3-dihydro-1H-indol-5-yl)乙酸>
247 y55ep9x $ $ $ $