HMDB0245634 RDKit 3D 6-Amino-9-benzyl-2-(2-methoxyethoxy)-9H-purin-8-ol 40 42 0 0 0 0 0 0 0 0999 V2000 5.3404 -0.8865 2.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8555 -1.9326 1.5873 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5096 -1.6223 1.2859 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8994 -2.6893 0.4383 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5556 -2.3959 0.1291 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1812 -1.2539 -0.5733 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0609 -0.3501 -1.0088 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7609 0.7611 -1.6857 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7041 1.7024 -2.1366 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4108 1.0053 -1.9659 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 1.9794 -2.5993 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5444 1.6665 -2.5504 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4828 2.3502 -3.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7217 0.5142 -1.8985 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9679 -0.1881 -1.6176 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5606 0.2321 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4532 1.2713 -0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9713 1.6133 1.0422 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6131 0.9247 2.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7188 -0.1166 2.0536 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2051 -0.4511 0.8074 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 0.0902 -1.5272 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1171 -1.0307 -0.8359 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4079 -1.0838 2.6454 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7474 -0.8812 3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2289 0.0920 1.8629 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5441 -0.6451 0.7984 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -1.5422 2.2159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0199 -3.6807 0.9032 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4387 -2.6850 -0.5522 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1465 1.7029 -3.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9896 2.4711 -1.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2256 2.8114 -3.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7576 -1.2801 -1.6237 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -0.0167 -2.4616 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7341 1.8094 -1.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6755 2.4335 1.1488 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0421 1.2237 3.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4442 -0.6500 2.9578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5069 -1.2727 0.7388 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 8 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 14 22 1 0 22 23 2 0 23 6 1 0 22 10 1 0 21 16 1 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 9 31 1 0 9 32 1 0 11 33 1 0 15 34 1 0 15 35 1 0 17 36 1 0 18 37 1 0 19 38 1 0 20 39 1 0 21 40 1 0 M END