HMDB0062574 RDKit 3D N(tele)-methylhistaminium 21 21 0 0 0 0 0 0 0 0999 V2000 3.5351 -0.5301 -0.4143 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2805 -0.1770 0.2314 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0599 -0.0849 1.5625 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7777 0.2641 1.7388 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1582 0.4014 0.5561 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2302 0.7668 0.2446 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1523 -0.4203 0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4863 0.1083 -0.1622 N 0 0 0 0 0 4 0 0 0 0 0 0 1.1156 0.1206 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2095 0.3474 -0.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3191 -0.7720 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9943 -1.4347 0.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7979 -0.2637 2.3522 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6657 1.4419 1.0292 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3237 1.3453 -0.7066 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8588 -1.1447 -0.6132 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2674 -0.8927 1.1716 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7808 0.7772 0.5883 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1699 -0.6458 -0.3453 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3492 0.6778 -1.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0366 0.1153 -1.4732 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 5 9 2 0 9 2 1 0 1 10 1 0 1 11 1 0 1 12 1 0 3 13 1 0 6 14 1 0 6 15 1 0 7 16 1 0 7 17 1 0 8 18 1 0 8 19 1 0 8 20 1 0 9 21 1 0 M CHG 1 8 1 M END