HMDB0032052 RDKit 3D alpha-Terpineol propanoate 37 37 0 0 0 0 0 0 0 0999 V2000 4.3833 1.6176 -1.1123 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9069 0.2901 -0.6409 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5015 0.3285 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9054 1.4285 -0.1678 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8254 -0.7326 0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5517 -0.9047 0.8316 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5298 -2.3987 1.2935 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2122 -0.1132 2.0461 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5658 -0.8784 -0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8668 -1.1000 0.4953 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9002 -0.0645 0.2978 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 0.5883 -0.8493 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9805 1.6441 -1.1486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9537 0.2244 -1.8876 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6242 0.3162 -1.0702 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4613 1.7192 -0.8679 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3259 1.6422 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8681 2.4847 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0493 -0.4555 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5308 -0.0182 0.2272 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5459 -2.6940 1.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -2.5001 2.1419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2773 -3.0422 0.4387 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -0.7761 2.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5049 0.7101 1.8641 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1683 0.2673 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3673 -1.7798 -0.8605 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7362 -1.3429 1.5888 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3324 -2.0617 0.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6249 0.1923 1.0852 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3477 2.0982 -0.1934 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8483 1.2261 -1.7023 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4596 2.4074 -1.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9241 0.9422 -2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0839 -0.8332 -2.1726 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6996 1.2736 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1431 0.2950 -1.8607 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 3 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 6 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 1 0 15 9 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 7 21 1 0 7 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 10 28 1 0 10 29 1 0 11 30 1 0 13 31 1 0 13 32 1 0 13 33 1 0 14 34 1 0 14 35 1 0 15 36 1 0 15 37 1 0 M END