HMDB0031739 RDKit 3D 7-Hydroxy-3,7-dimethyloctanal 32 31 0 0 0 0 0 0 0 0999 V2000 -2.1893 -1.4776 0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1139 0.0108 0.2928 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0001 0.8323 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4108 0.4438 -0.3535 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7235 -0.7180 -0.4666 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6805 0.4924 0.3532 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1063 0.2304 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5221 0.7252 -0.8202 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 0.1555 0.2531 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7668 0.7851 0.0986 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5426 -1.3247 0.0496 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9627 0.4542 1.5432 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2851 -1.8985 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1849 -1.7514 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -1.8674 0.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5014 0.1751 1.3506 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8264 1.9023 -0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8298 0.6956 -1.6662 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1409 1.1844 -0.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2377 -0.0881 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7048 1.5555 0.6224 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3369 0.5862 -1.8141 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1998 -0.8912 -1.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9725 0.3927 -1.8029 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 1.8336 -0.8472 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2428 0.9363 1.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4036 0.1704 -0.5656 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6938 1.8026 -0.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3261 -1.7062 0.7497 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9019 -1.4411 -1.0063 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5976 -1.8764 0.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0172 -0.3237 2.1533 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 2 0 2 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 9 12 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 6 20 1 0 6 21 1 0 7 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 10 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 11 31 1 0 12 32 1 0 M END