HMDB0037452 RDKit 3D Diosmetin 7-O-beta-D-glucuronopyranoside 54 57 0 0 0 0 0 0 0 0999 V2000 8.1874 -0.0200 -3.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 -0.8963 -1.9518 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8328 -1.0398 -1.3283 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7286 -0.3358 -1.7824 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4934 -0.4765 -1.1663 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 -1.3243 -0.0808 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0057 -1.4240 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7615 -2.2527 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -2.3667 2.1893 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3151 -3.1224 3.1561 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4786 -1.6213 1.6835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8003 -1.6552 2.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -2.4411 3.2448 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7935 -0.8536 1.6069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5324 -0.0468 0.5553 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4734 0.7615 -0.0571 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 0.8970 0.2639 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6011 0.4983 -0.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8269 1.0528 -0.9316 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7055 0.6604 0.1953 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9056 1.0989 0.2556 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3296 -0.1723 1.2307 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8705 2.5563 -1.0569 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0448 2.9127 -2.3767 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4798 3.0568 -0.6452 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4772 4.4179 -0.4081 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1803 2.3196 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1838 2.9396 1.3801 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2372 -0.0273 0.0568 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7642 -0.7983 0.6031 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9884 -0.7343 0.0784 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4329 -2.0098 0.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6738 -1.8830 -0.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -2.5816 0.1947 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1971 -0.1364 -3.4887 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9981 1.0028 -2.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4308 -0.2508 -3.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8904 0.3170 -2.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6558 0.0822 -1.5408 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -2.8629 2.0244 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6866 -3.0609 3.8179 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7847 -0.9194 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 0.2102 1.1197 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3361 0.6335 -1.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0789 -1.1435 1.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5996 3.0029 -0.3698 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1368 3.9088 -2.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7406 2.7383 -1.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8099 4.8222 -1.0226 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1166 2.2739 1.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 2.8208 2.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0051 0.6126 -0.7867 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3583 -2.6720 1.1794 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6586 -3.1995 0.9890 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 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 19 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 15 29 1 0 29 30 2 0 30 31 1 0 6 32 1 0 32 33 2 0 33 34 1 0 33 3 1 0 31 7 1 0 30 11 1 0 27 17 1 0 1 35 1 0 1 36 1 0 1 37 1 0 4 38 1 0 5 39 1 0 8 40 1 0 13 41 1 0 14 42 1 0 17 43 1 0 19 44 1 0 22 45 1 0 23 46 1 0 24 47 1 0 25 48 1 0 26 49 1 0 27 50 1 0 28 51 1 0 29 52 1 0 32 53 1 0 34 54 1 0 M END