HMDB0033513 RDKit 3D Gonyautoxin V 42 44 0 0 0 0 0 0 0 0999 V2000 -2.0199 0.1938 -3.1666 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8639 -0.2790 -1.9888 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9505 -1.3063 -1.5611 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -1.2943 -0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5146 -0.6313 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5633 -1.4567 -0.3833 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8823 -1.0724 -0.4307 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2798 0.2773 -0.7275 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2249 1.0213 -0.8353 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4891 0.7529 -0.8551 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0316 1.4103 -1.0258 S 0 0 0 0 0 6 0 0 0 0 0 0 6.9955 0.5278 -1.7469 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9968 2.7017 -1.8961 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6013 1.9590 0.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6023 -0.3026 1.5955 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4718 0.5803 2.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2155 1.3392 3.0673 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6663 0.5588 1.3416 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8783 1.3295 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9365 0.2005 1.4166 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1318 -1.0806 1.0984 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8575 -1.9819 0.3777 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6982 -1.5585 2.3409 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9786 -0.4232 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6186 0.1142 -0.8597 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7172 0.9334 -3.3583 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -1.8805 -2.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8792 -2.3239 0.2285 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 0.3384 -0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2046 -1.9524 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5973 -2.4018 0.3182 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9638 2.0290 -0.8467 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9259 1.2591 1.0678 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3359 -0.6159 2.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6917 1.3052 3.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 1.9137 0.4958 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9422 1.9742 2.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3263 0.1876 2.4376 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6802 0.3408 0.6383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1943 -2.5333 -0.1327 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3841 -0.8589 2.9629 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4964 0.7052 -0.9417 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 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 2 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 2 0 11 14 1 0 5 15 1 0 15 16 1 0 16 17 2 3 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 21 24 1 0 24 25 1 0 25 2 1 0 24 4 1 0 24 18 1 0 1 26 1 0 3 27 1 0 4 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 10 32 1 0 14 33 1 0 15 34 1 0 17 35 1 0 19 36 1 0 19 37 1 0 20 38 1 0 20 39 1 0 22 40 1 0 23 41 1 0 25 42 1 0 M END