HMDB0035427 RDKit 3D Glicoisoflavanone 52 54 0 0 0 0 0 0 0 0999 V2000 -4.5847 -3.1144 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3798 -2.7252 -0.5624 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -2.3602 -0.5192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0931 -3.2702 -0.4375 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1986 -2.8430 -0.4106 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1943 -3.7971 -0.3343 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5051 -1.4643 -0.4654 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9476 -1.1870 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3414 -0.6677 -1.8862 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8491 -0.7701 -1.8302 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5588 -1.5027 -2.4869 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4457 0.1614 -0.8402 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6885 0.6926 -1.0143 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1469 1.5715 -0.0278 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3594 1.8846 1.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8323 2.7774 2.0543 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1115 1.3136 1.1956 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6144 0.4240 0.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3618 -0.1450 0.3697 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5404 -0.5962 -0.5337 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2649 0.7904 -0.5601 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2278 1.4858 0.7015 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8494 -0.9592 -0.5621 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0046 -0.1150 -0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9113 1.3243 -0.4515 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5986 1.9788 0.5207 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4233 3.4765 0.6119 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5155 1.2738 1.4419 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9307 -4.0027 0.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3333 -2.3191 -0.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0138 -3.4597 -1.6232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3516 -4.3254 -0.3978 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9946 -4.7667 -0.2248 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5372 -2.0925 -0.3091 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9443 -1.3571 -2.6661 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0492 0.3657 -1.9453 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2676 0.3930 -1.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1293 1.9862 -0.1401 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7223 3.2221 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5167 1.5859 2.0598 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7067 1.4927 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9785 1.0867 1.4071 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4478 2.5889 0.5002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7397 -0.4893 0.2169 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6652 -0.3138 -1.5142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2702 1.8614 -1.1402 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3482 3.8867 1.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5215 3.6976 1.2264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3855 3.8930 -0.3964 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0264 0.7893 2.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2348 0.5761 0.9277 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2246 2.0635 1.8752 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 5 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 18 19 1 0 7 20 1 0 20 21 1 0 21 22 1 0 20 23 2 0 23 24 1 0 24 25 1 0 25 26 2 3 26 27 1 0 26 28 1 0 23 3 1 0 19 8 1 0 18 12 1 0 1 29 1 0 1 30 1 0 1 31 1 0 4 32 1 0 6 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 13 37 1 0 14 38 1 0 16 39 1 0 17 40 1 0 22 41 1 0 22 42 1 0 22 43 1 0 24 44 1 0 24 45 1 0 25 46 1 0 27 47 1 0 27 48 1 0 27 49 1 0 28 50 1 0 28 51 1 0 28 52 1 0 M END