HMDB0252766 RDKit 3D Glucoheptonic acid 29 28 0 0 0 0 0 0 0 0999 V2000 3.4834 1.7024 -0.3921 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 1.3443 -0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3191 2.2744 -0.3213 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0138 -0.0135 0.2967 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3132 -0.6199 0.4725 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3326 -0.9062 -0.6946 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3536 -2.1982 -0.1114 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.5460 -1.1347 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1706 0.7025 -1.6939 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1615 -0.9584 -0.2558 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9398 -2.2265 0.3103 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.0587 0.8903 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6429 -0.7018 1.5027 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0867 1.2514 0.3809 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6181 1.9733 1.4585 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0306 2.9591 0.3703 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5854 -0.0748 1.3103 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8473 -0.3227 -0.3069 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0454 -1.0064 -1.5656 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2655 -2.4736 0.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1836 -1.2434 -2.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0227 0.7652 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1081 -1.0853 -0.8573 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -2.7237 0.4745 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7598 0.0552 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3099 -1.2641 2.2489 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3233 1.8326 -0.1051 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9174 1.0669 -0.3266 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4028 2.4958 1.1524 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 3 16 1 0 4 17 1 0 5 18 1 0 6 19 1 0 7 20 1 0 8 21 1 0 9 22 1 0 10 23 1 0 11 24 1 0 12 25 1 0 13 26 1 0 14 27 1 0 14 28 1 0 15 29 1 0 M END