HMDB0030983 RDKit 3D 5-(8-Pentadecenyl)-1,3-benzenediol 57 57 0 0 0 0 0 0 0 0999 V2000 8.0872 2.4070 0.7301 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2103 1.2380 0.3123 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9179 1.3670 -1.1658 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 0.2688 -1.6989 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7235 0.2514 -0.9834 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8372 -0.8635 -1.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5506 -0.7909 -0.7468 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0989 -1.7764 -0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8184 -1.6678 0.7363 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1891 -0.3289 0.5139 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1123 -0.1836 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1393 -1.2096 0.8589 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3883 -0.9733 1.6651 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5038 -1.9087 1.3585 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0129 -1.8241 -0.0585 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5735 -0.4994 -0.3734 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9244 -0.2884 -0.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5377 0.9155 -0.3631 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8801 1.1623 -0.1014 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8069 1.9575 -0.9215 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4697 1.7631 -1.2005 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7536 2.8127 -1.7578 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8647 0.5271 -0.9208 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5576 3.1203 1.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4372 2.9616 -0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9469 1.9910 1.3219 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3005 1.2991 0.9401 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7178 0.2729 0.5147 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8943 1.3632 -1.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3742 2.3315 -1.3275 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 0.3827 -2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5586 -0.7035 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1772 1.2005 -1.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8703 0.1126 0.1041 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5667 -0.6033 -2.5729 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3096 -1.8497 -1.4417 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0017 0.1344 -0.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6944 -2.6892 0.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1607 -2.5061 0.4261 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9958 -1.7588 1.8472 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0146 -0.2153 -0.5957 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8776 0.4484 0.8966 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.2410 2.3452 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 0.8157 1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7719 -2.2495 1.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3845 -1.1453 -0.2102 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7683 0.0661 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1282 -1.1101 2.7462 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3483 -1.6306 2.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2703 -2.9683 1.6324 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8176 -2.6004 -0.2079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1864 -2.0008 -0.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5369 -1.0801 0.3424 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4489 0.4081 0.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 2.9133 -1.1373 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7806 2.7588 -1.9918 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8295 0.4160 -1.1556 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 2 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 1 0 18 20 2 0 20 21 1 0 21 22 1 0 21 23 2 0 23 16 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 6 36 1 0 7 37 1 0 8 38 1 0 9 39 1 0 9 40 1 0 10 41 1 0 10 42 1 0 11 43 1 0 11 44 1 0 12 45 1 0 12 46 1 0 13 47 1 0 13 48 1 0 14 49 1 0 14 50 1 0 15 51 1 0 15 52 1 0 17 53 1 0 19 54 1 0 20 55 1 0 22 56 1 0 23 57 1 0 M END