HMDB0033664 RDKit 3D N'-Hydroxysaxitoxin 39 41 0 0 0 0 0 0 0 0999 V2000 -0.8040 1.8589 3.0368 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7647 1.0464 2.0317 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2753 1.0245 1.0169 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0392 -0.1985 0.3495 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7325 -0.5596 -0.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2003 -0.7889 -0.5731 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8272 0.4067 -0.1606 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1754 0.3817 0.1595 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7733 -0.7202 0.0632 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8811 1.5349 0.5818 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1734 1.4716 0.8801 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2067 -1.8789 -1.2926 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1314 -2.2582 -0.8906 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5012 -3.4848 -1.0259 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0255 -1.2989 -0.3656 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4445 -1.0803 -0.3315 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5744 0.4590 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1077 0.9498 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7389 1.0557 -1.7405 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0622 2.1400 0.2623 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4613 -0.1970 0.3063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7245 0.0008 1.7006 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0905 2.5798 3.2169 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9876 1.7570 0.8684 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2731 -1.0126 1.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6839 0.1522 -1.7098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3032 -1.5637 0.2425 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7376 -1.2417 -1.4455 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3657 2.4324 0.6533 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6403 0.7275 0.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8364 -2.4629 -1.8562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -4.1883 -1.4179 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8202 -1.4570 0.6393 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -1.5540 -1.1723 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 0.7706 -1.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0873 0.7747 0.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 1.9407 -1.9242 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1346 2.8986 -0.3812 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3774 -0.4182 2.3709 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 5 12 1 0 12 13 1 0 13 14 2 3 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 18 21 1 0 21 22 1 0 22 2 1 0 21 4 1 0 21 15 1 0 1 23 1 0 3 24 1 0 4 25 1 0 5 26 1 0 6 27 1 0 6 28 1 0 10 29 1 0 11 30 1 0 12 31 1 0 14 32 1 0 16 33 1 0 16 34 1 0 17 35 1 0 17 36 1 0 19 37 1 0 20 38 1 0 22 39 1 0 M END