HMDB0035678 RDKit 3D 3-Hydroxy-1-phenyl-1-heptadecanone 63 63 0 0 0 0 0 0 0 0999 V2000 8.9612 -0.0192 1.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3313 -1.1587 0.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8499 -0.8894 0.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6921 0.3736 -0.7086 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2366 0.6759 -0.9686 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4549 0.8521 0.2992 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0171 1.1714 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3217 0.1058 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9041 0.5303 -1.0899 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1452 0.7539 0.1624 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0975 -0.4696 1.0199 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5414 -1.6047 0.2915 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9472 -1.2462 -0.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -0.9276 1.0744 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2352 -0.5810 0.7277 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7796 -1.6602 0.0914 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3316 0.6459 -0.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6141 1.1220 -0.4986 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5386 2.0721 -1.4315 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9544 0.7789 -0.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3480 -0.0748 0.8596 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7052 -0.3350 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7025 0.2080 0.3272 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3053 1.0681 -0.6818 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9887 1.3525 -0.9205 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 0.4482 1.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8188 -0.4487 1.6436 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4083 0.7355 0.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4566 -2.0792 0.8912 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8467 -1.2180 -0.6679 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3254 -0.7549 1.0549 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4053 -1.7762 -0.4165 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0909 1.2022 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2523 0.3202 -1.6622 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8325 -0.1001 -1.6432 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1747 1.6323 -1.5301 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4534 -0.0565 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8433 1.7415 0.8556 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4943 1.2478 0.9484 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0337 2.1521 -0.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2886 -0.8593 -0.2679 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8554 -0.1231 -1.7845 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9186 1.4379 -1.7475 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4154 -0.2482 -1.7161 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5427 1.5803 0.7929 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9165 1.0524 -0.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4403 -0.1925 1.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -0.7495 1.3833 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5497 -2.5137 0.9583 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0997 -1.8657 -0.5885 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3834 -2.1642 -0.6512 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9663 -0.4296 -0.8585 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8177 -1.8141 1.7342 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3867 -0.0879 1.6594 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6487 -0.4111 1.7509 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4489 -2.5232 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8568 1.5362 0.5008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6402 0.5595 -0.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6405 -0.5439 1.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9608 -1.0147 1.8669 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7541 0.0335 0.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0714 1.5346 -1.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 2.0158 -1.7039 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 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 20 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 6 37 1 0 6 38 1 0 7 39 1 0 7 40 1 0 8 41 1 0 8 42 1 0 9 43 1 0 9 44 1 0 10 45 1 0 10 46 1 0 11 47 1 0 11 48 1 0 12 49 1 0 12 50 1 0 13 51 1 0 13 52 1 0 14 53 1 0 14 54 1 0 15 55 1 0 16 56 1 0 17 57 1 0 17 58 1 0 21 59 1 0 22 60 1 0 23 61 1 0 24 62 1 0 25 63 1 0 M END