HMDB0002203 RDKit 3D 3-Hydroxycapric acid 33 32 0 0 0 0 0 0 0 0999 V2000 4.3136 0.9773 -0.8882 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0728 0.0818 0.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1089 -1.0193 0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7289 -0.6242 -0.3372 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0086 0.1958 0.6776 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3826 0.5672 0.2211 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2327 -0.6213 -0.0515 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6308 -0.3342 -0.4953 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7035 0.4010 -1.6547 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5454 0.2272 0.5382 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8679 0.4352 -0.1006 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2388 1.5897 -0.5115 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7731 -0.5965 -0.2899 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3966 1.2898 -0.9327 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0652 0.4247 -1.8178 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6849 1.8983 -0.7977 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8456 0.6846 1.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0677 -0.4092 0.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5173 -1.6219 -0.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0454 -1.7126 0.9213 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1607 -1.5973 -0.4251 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6765 -0.1449 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -0.3797 1.6332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5445 1.1259 0.9586 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2315 1.1768 -0.7119 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8149 1.2659 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7688 -1.2581 -0.8331 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2986 -1.2440 0.8642 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -1.3520 -0.7638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1004 1.2909 -1.4287 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1809 1.2393 0.8892 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -0.3932 1.4399 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5989 -1.5632 -0.1698 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 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 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 3 19 1 0 3 20 1 0 4 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 8 29 1 6 9 30 1 0 10 31 1 0 10 32 1 0 13 33 1 0 M END