HMDB0247378 RDKit 3D 5-[[Methyl(prop-2-ynyl)amino]methyl]quinolin-8-ol 31 32 0 0 0 0 0 0 0 0999 V2000 3.5400 1.8243 1.8015 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5048 0.9743 0.9415 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4399 -0.0636 -0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1972 0.0996 -0.8672 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2164 -0.9656 -1.8635 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1277 -0.0393 0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 0.1024 -0.4736 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5683 0.3576 -1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8972 0.4785 -2.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9127 0.3387 -1.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2309 0.4612 -1.7173 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5742 0.0817 0.0212 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5646 -0.0580 0.9232 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3495 -0.3104 2.2246 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0513 -0.4357 2.6756 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -0.2989 1.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2698 -0.0377 0.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5584 2.5634 2.5659 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2884 -0.0395 -0.7777 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3553 -1.0712 0.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0748 -1.6673 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3551 -0.5597 -2.8867 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2742 -1.5564 -1.7531 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -0.9899 0.6463 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2674 0.7702 0.8359 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2312 0.4698 -2.4844 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1141 0.6824 -3.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9576 0.3480 -0.9991 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1535 -0.4225 2.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -0.6419 3.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.3944 2.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 2 3 1 0 3 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 7 1 0 17 12 1 0 1 18 1 0 3 19 1 0 3 20 1 0 5 21 1 0 5 22 1 0 5 23 1 0 6 24 1 0 6 25 1 0 8 26 1 0 9 27 1 0 11 28 1 0 14 29 1 0 15 30 1 0 16 31 1 0 M END