HMDB0032181 RDKit 3D alpha-Butyl-omega-hydroxypoly(oxyethylene) poly(oxypropylene) 45 44 0 0 0 0 0 0 0 0999 V2000 5.9200 1.5902 0.7365 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0969 1.2279 -0.4614 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -0.2222 -0.3403 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8608 -0.6812 -1.5025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7122 0.0772 -1.5821 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9374 -0.0203 -0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6958 0.8482 -0.6706 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.3870 -1.7711 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4369 -0.8962 -1.6668 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4967 -1.0084 -0.5691 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8455 -2.4813 -0.3617 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -0.2407 -0.9675 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9261 0.7513 -0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 0.1802 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6348 -0.6541 0.9373 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6220 0.1110 0.3792 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9991 1.1415 1.1976 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9570 1.2672 0.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5659 1.0331 1.6315 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 2.6713 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2251 1.8929 -0.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6627 1.3362 -1.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6168 -0.8806 -0.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2538 -0.3807 0.6412 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5691 -1.7538 -1.3978 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4056 -0.5388 -2.4669 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4263 0.4354 0.4442 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7112 -1.0593 -0.2361 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0334 1.8928 -0.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1142 0.9269 0.2547 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9235 -1.1855 -2.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3579 -1.6586 -1.5383 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0912 -0.6758 0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -2.6837 0.6767 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6998 -2.6897 -1.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9897 -3.1337 -0.5626 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 1.2858 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1004 1.4760 0.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5387 0.9312 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6521 -0.5376 1.6389 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3974 -1.4796 0.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0057 -1.0278 1.9261 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8303 1.6996 0.6687 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1492 1.8705 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3569 0.8564 2.1918 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 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 6 27 1 0 6 28 1 0 7 29 1 0 7 30 1 0 9 31 1 0 9 32 1 0 10 33 1 0 11 34 1 0 11 35 1 0 11 36 1 0 13 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 17 43 1 0 17 44 1 0 17 45 1 0 M END