HMDB0033872 RDKit 3D 3-Pentadecylphenol 58 58 0 0 0 0 0 0 0 0999 V2000 -5.2190 -0.9094 2.4172 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3913 -1.3628 1.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0396 -0.3014 0.1457 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2376 0.9625 0.0975 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8488 0.7367 -0.4721 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9084 0.1996 -1.8781 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5145 -0.0145 -2.3947 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6673 1.2160 -2.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2854 0.9242 -2.9917 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4696 -0.0751 -2.1462 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6647 0.3740 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4186 -0.6641 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7753 -0.9787 -0.4325 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4423 -1.9985 0.4469 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6737 -1.5114 1.8532 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5821 -0.3205 1.7772 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1166 0.9682 1.6816 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0174 2.0380 1.6091 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3752 1.7888 1.6346 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8554 0.5039 1.7302 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2101 0.2837 1.7537 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9664 -0.5364 1.8006 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -0.6790 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7671 -1.7502 2.9932 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5377 -0.0555 2.5291 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4694 -1.7734 0.5469 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1164 -2.2239 1.0242 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0065 -0.0467 0.6516 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 -0.6935 -0.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7516 1.6477 -0.6226 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2012 1.5039 1.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3518 -0.0515 0.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2438 1.6399 -0.4058 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4046 0.9128 -2.5743 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4225 -0.7836 -1.8785 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0708 -0.8258 -1.7821 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 -0.4222 -3.4357 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6112 1.8107 -1.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1447 1.8895 -3.2261 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3181 1.8533 -3.0342 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3903 0.5568 -4.0313 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4864 -0.2325 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0905 -1.0270 -2.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 0.5889 -0.1975 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2848 1.2993 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7932 -1.6062 -0.0555 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4323 -0.4141 1.1326 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3642 -0.0189 -0.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7645 -1.2980 -1.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4261 -2.2288 -0.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9081 -2.9762 0.4309 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7232 -1.2414 2.3413 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1549 -2.3179 2.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0508 1.1796 1.6642 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6481 3.0445 1.5342 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0467 2.6532 1.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6634 -0.5960 1.8199 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3001 -1.5431 1.8753 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 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 20 22 2 0 22 16 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 0 9 41 1 0 10 42 1 0 10 43 1 0 11 44 1 0 11 45 1 0 12 46 1 0 12 47 1 0 13 48 1 0 13 49 1 0 14 50 1 0 14 51 1 0 15 52 1 0 15 53 1 0 17 54 1 0 18 55 1 0 19 56 1 0 21 57 1 0 22 58 1 0 M END