HMDB0033093 RDKit 3D 3-(4-Hydroxy-3-methoxyphenyl)-1,2-propanediol 28 28 0 0 0 0 0 0 0 0999 V2000 3.1864 -0.2882 -2.3767 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2901 -0.0360 -1.0079 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 0.2497 -0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9369 0.3274 -0.5731 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1069 0.6156 0.2772 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5145 0.7025 -0.1386 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2515 -0.6036 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2721 -1.1120 1.2411 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6995 -0.3199 -0.4432 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4658 -1.4709 -0.4054 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1851 0.8381 1.6083 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 0.7711 2.0619 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5188 0.4771 1.1741 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8351 0.4039 1.6047 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2244 -0.7348 -2.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9658 -1.0678 -2.6198 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4155 0.6521 -2.9166 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6948 0.1561 -1.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6016 1.0941 -1.1613 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0502 1.4208 0.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7977 -1.3246 -0.7546 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5396 -1.7378 1.4159 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1201 0.3906 0.2977 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7268 0.1639 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 -2.1609 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6297 1.0708 2.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6894 0.9520 3.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0227 0.5707 2.5833 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 5 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 13 3 1 0 1 15 1 0 1 16 1 0 1 17 1 0 4 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 8 22 1 0 9 23 1 0 9 24 1 0 10 25 1 0 11 26 1 0 12 27 1 0 14 28 1 0 M END