HMDB0036117 RDKit 3D (1'R)-Nepetalic acid 29 29 0 0 0 0 0 0 0 0999 V2000 -2.7192 -0.8034 -0.7211 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7777 0.1780 0.0176 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3404 1.5242 -0.2736 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3965 1.8055 0.2501 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4228 -0.0579 -0.5634 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0595 -1.4901 -0.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0535 -1.4686 0.6841 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8307 -0.2348 0.2759 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6655 -0.4166 -0.9454 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7036 0.7414 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5209 1.5743 1.1165 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.6154 1.7484 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5805 2.3546 1.5546 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2976 -1.0500 -1.6994 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7141 -0.3428 -0.8966 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9051 -1.7022 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9009 -0.0468 1.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8461 2.2342 -0.9199 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5693 0.0867 -1.6885 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -2.1054 0.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3564 -1.9103 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7394 -2.3302 0.6106 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6559 -1.3169 1.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4702 0.1179 1.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7266 -0.6534 -0.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2768 -1.2334 -1.5895 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7078 0.5022 -1.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0486 1.4109 -0.9237 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0689 3.0176 0.9542 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 2 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 10 5 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 3 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 7 22 1 0 7 23 1 0 8 24 1 0 9 25 1 0 9 26 1 0 9 27 1 0 10 28 1 0 13 29 1 0 M END