HMDB0000962 RDKit 3D Lipoamide 27 27 0 0 0 0 0 0 0 0999 V2000 4.1624 0.3932 0.3891 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9855 -0.3873 0.3076 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4768 -0.8403 1.3904 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3012 -0.7180 -0.9419 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0201 -1.4585 -0.8117 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0532 -0.7262 -0.0416 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 0.5889 -0.6867 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4575 1.3606 0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7111 0.5610 0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7336 1.3152 0.9176 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9603 1.5255 2.5780 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9411 1.6072 1.7917 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0428 0.1874 -0.1207 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1539 1.2335 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9983 -1.3896 -1.5235 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1959 0.1981 -1.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2355 -2.3879 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6114 -1.8158 -1.7776 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9579 -1.4079 -0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2238 -0.6851 1.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 1.2487 -0.7966 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7191 0.3519 -1.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6753 2.3193 -0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 0.4604 -0.9092 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6217 -0.4479 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9421 2.3189 0.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5985 0.6638 1.0563 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 8 1 0 1 13 1 0 1 14 1 0 4 15 1 0 4 16 1 0 5 17 1 0 5 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 8 23 1 0 9 24 1 0 9 25 1 0 10 26 1 0 10 27 1 0 M END