HMDB0094722 RDKit 3D 5-hydroxyhexanoylglycine 28 27 0 0 0 0 0 0 0 0999 V2000 -4.2523 1.1198 -0.0572 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8312 0.8651 0.3176 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7541 0.2017 1.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0997 -0.0007 -0.7059 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6913 -0.1595 -0.1793 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1723 -1.0026 -1.0911 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5158 -1.0758 -0.4591 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -1.6252 0.8078 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5186 -0.6160 -1.1256 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8163 -0.6741 -0.5432 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4775 0.6542 -0.4536 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 0.6569 0.0601 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9163 1.8299 -0.8813 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5897 2.0352 0.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3961 1.3274 -1.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8867 0.2947 0.3201 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2646 1.8331 0.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5707 -0.3166 1.6499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5527 -1.0303 -0.7471 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0973 0.4526 -1.7037 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2021 0.8336 -0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6938 -0.6238 0.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2322 -0.5947 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2565 -2.0350 -1.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8936 -2.6060 0.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4622 -1.2767 -1.2479 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7787 -1.1422 0.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0545 2.6750 -0.3456 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 2 3 9 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 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 5 22 1 0 6 23 1 0 6 24 1 0 8 25 1 0 10 26 1 0 10 27 1 0 13 28 1 0 M END