HMDB0035457 RDKit 3D (±)-5-Hydroxy-4-octanone 26 25 0 0 0 0 0 0 0 0999 V2000 -4.0103 -0.1232 0.6261 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7045 0.6074 0.6113 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7607 -0.1250 -0.3181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4256 0.5303 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2699 1.5370 0.2683 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 -0.0659 -1.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1086 -1.2046 -1.8985 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -0.4679 -0.5562 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5814 0.6451 0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8265 0.0287 0.7787 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1062 -0.6737 1.5727 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8486 0.5861 0.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0751 -0.8774 -0.2053 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8169 1.6705 0.2709 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2007 0.6172 1.6196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -1.1669 0.0484 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -0.1714 -1.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 0.6962 -2.0202 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0391 -1.9315 -1.2116 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5199 -0.9429 -1.3217 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6696 -1.2728 0.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 1.0678 0.9274 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8439 1.4814 -0.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5803 -1.0151 1.0618 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1051 0.5849 1.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6312 -0.0140 0.0283 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 4 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 6 18 1 0 7 19 1 0 8 20 1 0 8 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 10 26 1 0 M END