HMDB0037252 RDKit 3D 5,8-Dihydroxy-3-(4-hydroxybenzyl)-7-methoxy-4-chromanone 8-acetate 44 46 0 0 0 0 0 0 0 0999 V2000 -5.9771 1.2307 0.8057 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0269 0.4490 0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6977 0.8085 -0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2657 2.0118 0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9318 2.4321 0.3746 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5577 3.6346 0.9042 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0204 1.6474 -0.2722 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4654 0.4321 -0.7878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 0.0228 -0.6588 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2152 -1.1835 -1.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2067 -2.3657 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7005 -3.5943 -1.1218 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7821 -2.4015 0.6888 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5015 -0.3322 -1.4356 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -0.3823 -0.9631 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3837 0.9616 -0.6336 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3099 1.0063 0.5519 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5167 0.1752 0.4217 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6754 0.6401 -0.1557 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7894 -0.1714 -0.2512 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7435 -1.4624 0.2365 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8598 -2.2955 0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6091 -1.9449 0.8119 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5004 -1.1108 0.8974 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3739 2.0238 -0.4578 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6898 3.2220 -0.4657 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9799 0.8322 0.5527 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7878 1.2699 1.8967 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8895 2.2698 0.4072 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9716 2.6615 1.0267 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7342 4.1277 0.9551 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -4.0803 -0.4484 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8914 -4.2740 -1.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2759 -3.3402 -2.0532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4506 -0.8795 -1.7421 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8107 -1.0491 -0.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9928 1.2911 -1.5317 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7264 0.6388 1.4236 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6387 2.0355 0.7641 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7527 1.6553 -0.5537 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7211 0.1717 -0.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5129 -2.2739 0.9296 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 -2.9515 1.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6273 -1.5583 1.3737 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 2 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 2 0 8 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 2 0 16 25 1 0 25 26 2 0 9 3 1 0 24 18 1 0 25 7 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 6 31 1 0 12 32 1 0 12 33 1 0 12 34 1 0 15 35 1 0 15 36 1 0 16 37 1 0 17 38 1 0 17 39 1 0 19 40 1 0 20 41 1 0 22 42 1 0 23 43 1 0 24 44 1 0 M END