Mrv0541 02231217052 dφ14 14 0 0 0 0 999 V2000型-0.0677 1.1907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6467 0.7782 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6467 -0.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0677 -0.4593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0677 -1.2843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7822 -0.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7822 -1.6968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4967 -0.4593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4967 -1.2843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2112 -1.6968 0.0000 0 0 0 0 0 0 0 0 0 0 0 0 1.3612 1.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3612 2.0157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0757 0.7782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 0.4863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 14 1 1 0 0 0 3 1 0 0 0 0 4 5 1 2 0 0 0 0 4 6 0 0 0 0 5 7 1 0 0 0 0 6 8 2 0 0 0 0 7 9 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 M >结束 DB03660 > drugbank > [H] [C@] (N) (CC1 = CC = C (I) C = C1) C (O) = O > InChI = 1 s / C9H10INO2 c10-7-3-1-6 (2-4-7) 5 - 8 9 (11) (12) 13 / h1-4 8 H, 5、11 h2, (H、12、13) / t8 - / mo / s1 > PZNQZSRPDOEBMS-QMMMGPOBSA-N > C9H10INO2 > 291.0857 > 290.975621989 > 3 > 23日> -0.0036047575616319216 > 22.870387041648605 > 1 > 2 > 0 > 1 > (2)2-amino-3 - (4-iodophenyl)丙酸> -1.25 > -0.2560571883214765 > -3.03 > 0 > 0 > 1 > 0 > 1.2738991793905419 > 9.441328738532649 > 63.32000000000001 > 58.47880000000001 > 3 > 1 > 2.74 e-01 g / l > 四氢叶酸> 0 > DB03660 > EXPT02587 > 实验> 4-Iodo-L-phenylalanine > 4-iodophenylalanine;p-Iodo-L-phenylalanine;p-iodophenylalanine $ $ $ $
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