HMDB0034712 RDKit 3D Prexanthoperol 49 51 0 0 0 0 0 0 0 0999 V2000 4.9340 0.6332 1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5792 0.5160 -0.2749 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3281 -0.6793 -0.8134 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1016 0.3108 -0.3567 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3552 0.0869 0.7825 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9832 -0.1213 0.7674 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3262 -0.1079 -0.3988 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0373 0.1135 -1.5627 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4219 0.3240 -1.5596 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1135 0.5433 -2.7278 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1553 -0.2999 -0.6027 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2025 -1.4199 -1.6624 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 0.9456 -1.3091 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8856 1.5459 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8373 0.4113 -0.5006 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2673 -0.2045 0.7676 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -1.2890 1.1765 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3775 0.8592 1.8377 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8914 -0.7359 0.5815 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.6068 1.8746 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8499 -0.7064 2.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2403 -0.3790 2.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8781 -0.3856 3.0958 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3554 1.4141 1.7067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -0.3793 1.6321 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0102 0.9143 1.3068 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 1.4480 -0.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5822 -1.4700 -1.0717 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9654 -0.4075 -1.6898 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 -1.1051 -0.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8264 0.0655 1.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5709 0.1377 -2.5451 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1063 0.6933 -2.6951 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1454 -0.9933 -2.6861 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1173 -2.0312 -1.5109 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3329 -2.1002 -1.5646 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8452 1.7778 -1.2806 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7466 0.7851 -2.4219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 2.1871 -1.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7277 2.1478 0.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8391 0.7998 -0.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8621 -0.3259 -1.3312 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0399 -1.6977 2.1761 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2193 -2.0630 0.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2714 -0.8063 1.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0773 1.6781 1.5343 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 0.4690 2.7858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 1.3736 2.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0345 -1.8662 0.5047 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 7 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 16 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 2 0 9 4 1 0 19 11 1 0 22 6 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 5 31 1 0 8 32 1 0 10 33 1 0 12 34 1 0 12 35 1 0 12 36 1 0 13 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 17 43 1 0 17 44 1 0 17 45 1 0 18 46 1 0 18 47 1 0 18 48 1 0 19 49 1 0 M END