HMDB0030829 RDKit 3D Aloeemodin 30 32 0 0 0 0 0 0 0 0999 V2000 -0.2174 2.6970 0.8487 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4283 1.5153 0.4395 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7998 1.0380 0.3081 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8419 1.8760 0.6297 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 1.4927 0.5298 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 0.2283 0.0935 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4137 -0.6765 -0.2511 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7358 -1.9225 -0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0901 -0.2372 -0.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9643 -1.1121 -0.4686 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2524 -2.2642 -0.8654 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4267 -0.6748 -0.3518 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4628 -1.5234 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3055 -2.8061 -1.1231 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7663 -1.0319 -0.5388 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0013 0.2348 -0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3797 0.7395 0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3235 -0.2159 -0.3195 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9592 1.0558 0.2152 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6549 0.6073 0.0922 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 2.8960 0.9829 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9809 2.1664 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4501 -0.1533 -0.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3104 -2.7261 -0.9733 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5054 -3.3089 -1.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5886 -1.6777 -0.7872 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5217 1.1375 1.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4886 1.5904 -0.6927 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2119 -1.0020 0.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1428 2.0576 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 16 19 1 0 19 20 2 0 20 2 1 0 9 3 1 0 20 12 1 0 4 21 1 0 5 22 1 0 6 23 1 0 8 24 1 0 14 25 1 0 15 26 1 0 17 27 1 0 17 28 1 0 18 29 1 0 19 30 1 0 M END