HMDB0302372 RDKit 3D Linalol oxide 30 30 0 0 0 0 0 0 0 0999 V2000 -3.2172 1.7443 0.1998 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3275 0.9792 -0.3914 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1356 -0.4525 -0.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0836 -0.9216 1.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3562 -1.2468 -1.2016 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7347 -0.7532 0.4091 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2916 -0.4049 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6361 -0.7496 -0.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8095 0.0753 1.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 0.1044 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0756 -0.4372 0.4273 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8118 1.4338 -0.7122 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8679 1.3693 0.9745 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3075 2.7763 -0.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6947 1.3934 -1.1629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7838 -1.9583 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1352 -0.9870 0.6636 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9796 -0.3116 1.9279 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3466 -1.3792 -1.2255 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5393 -0.1532 1.3092 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7029 -1.8324 0.6658 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0798 -0.9037 -1.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1943 0.6956 -0.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7366 -1.8420 0.1462 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0807 -1.5291 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8948 -0.1024 -0.2585 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3311 0.0142 1.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5019 2.2840 -0.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 1.4521 -1.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8476 1.6430 -1.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 3 5 1 0 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 10 8 1 0 1 13 1 0 1 14 1 0 2 15 1 0 4 16 1 0 4 17 1 0 4 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 7 22 1 0 7 23 1 0 8 24 1 0 11 25 1 0 11 26 1 0 11 27 1 0 12 28 1 0 12 29 1 0 12 30 1 0 M END