HMDB0303095 RDKit 3D (3R)-Acetoxy-(5S)-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-decane 54 54 0 0 0 0 0 0 0 0999 V2000 -5.3918 -1.8126 -1.7011 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0165 -0.4097 -2.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4254 0.5481 -1.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7308 0.1926 0.2558 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1992 0.2559 0.1345 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6226 -0.1147 1.4699 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0336 0.7638 2.4806 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1782 -0.4426 1.4922 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2145 0.5949 1.0657 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1884 -0.0384 1.2057 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2492 0.9479 0.7915 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5661 0.2967 0.9432 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2694 0.3778 2.1315 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5004 -0.2308 2.2737 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0585 -0.9304 1.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 -1.5552 1.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3803 -1.0349 0.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -1.7487 -1.0013 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2991 -1.8681 -2.2328 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1524 -0.4221 -0.0962 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3229 0.9410 -0.2865 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3248 2.2630 -0.7202 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4414 2.5651 -2.1546 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2284 3.1855 0.0992 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4115 -1.8202 -1.2719 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3623 -2.5102 -2.5763 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 -2.1982 -0.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5212 -0.1642 -3.0762 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9314 -0.3321 -2.2914 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5165 0.4515 -0.8941 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 1.6042 -1.3289 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0459 -0.8244 0.5635 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0763 0.8821 1.0514 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9358 1.2774 -0.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8574 -0.5100 -0.5883 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1547 -1.0867 1.7439 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3225 0.8099 3.1881 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9453 -0.8015 2.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0574 -1.3715 0.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1729 1.5141 1.6547 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3858 -0.3315 2.2515 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -0.9311 0.5595 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2544 1.8539 1.4171 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1492 1.2487 -0.2743 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8151 0.9348 2.9369 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0375 -0.1545 3.2182 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8088 -1.4984 2.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9111 -0.8774 -2.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0802 -2.1998 -2.9771 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 -2.6528 -2.1915 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5963 -0.4874 -1.0387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0092 1.7779 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 3.5154 -2.3991 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5095 2.6197 -2.4134 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 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 17 20 2 0 9 21 1 0 21 22 1 0 22 23 1 0 22 24 2 0 20 12 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 5 34 1 0 5 35 1 0 6 36 1 1 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 1 10 41 1 0 10 42 1 0 11 43 1 0 11 44 1 0 13 45 1 0 14 46 1 0 16 47 1 0 19 48 1 0 19 49 1 0 19 50 1 0 20 51 1 0 23 52 1 0 23 53 1 0 23 54 1 0 M END